USER MOD reduce.3.24.130724 H: found=0, std=0, add=1291, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1284 hydrogens (24 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 153 HIS : no HE2:sc= -5.51! C(o=-5.5!,f=-7.9!) USER MOD Set 1.2: A 155 TYR OH : rot 141:sc= 0.048 USER MOD Set 2.1: A 112 THR OG1 : rot 180:sc= -0.0648 USER MOD Set 2.2: A 159 GLN : amide:sc= -2.67! K(o=-2.7!,f=0.5) USER MOD Set 3.1: A 58 THR OG1 : rot -120:sc= 0.835 USER MOD Set 3.2: A 89 HIS : no HD1:sc= -0.221 X(o=1.2,f=1.5) USER MOD Set 3.3: A 92 GLN : amide:sc= 0.635 K(o=1.2,f=0.45) USER MOD Set 4.1: A 39 MET CE :methyl -121:sc= -3.3! (180deg=-6.05!) USER MOD Set 4.2: A 59 ASN : amide:sc= -1.2 K(o=-4.5,f=-2.1) USER MOD Single : A 1 THR N :NH3+ 163:sc= 0.58 (180deg=0.323) USER MOD Single : A 1 THR OG1 : rot 140:sc= 1.3 USER MOD Single : A 7 GLN : amide:sc= 0.963 K(o=0.96,f=-5.3!) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 HIS : no HE2:sc= -0.0758 K(o=-0.076,f=-2.9!) USER MOD Single : A 22 HIS : no HD1:sc= -0.693 X(o=-0.69,f=-0.25) USER MOD Single : A 28 HIS : no HD1:sc= -0.224 X(o=-0.22,f=-0.38) USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= -0.249 X(o=-0.25,f=-0.044) USER MOD Single : A 34 THR OG1 : rot -76:sc= 0.43 USER MOD Single : A 37 LYS NZ :NH3+ -168:sc=-0.000218 (180deg=-0.224) USER MOD Single : A 45 THR OG1 : rot -140:sc= 0 USER MOD Single : A 46 TYR OH : rot 180:sc= -0.779 USER MOD Single : A 48 SER OG : rot 152:sc= 0.03 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 HIS : no HD1:sc= -1.85 K(o=-1.8,f=-0.51) USER MOD Single : A 65 GLN : amide:sc= -0.549 K(o=-0.55,f=-4.3!) USER MOD Single : A 68 TYR OH : rot 159:sc= 0.231 USER MOD Single : A 69 GLN : amide:sc= -0.108 K(o=-0.11,f=-1.3!) USER MOD Single : A 71 GLN : amide:sc= -0.142 X(o=-0.14,f=-0.45) USER MOD Single : A 77 HIS : no HE2:sc= -3.34! C(o=-3.3!,f=-8.7!) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ -121:sc= -0.0648 (180deg=-0.61) USER MOD Single : A 88 GLN : amide:sc= -0.0816 X(o=-0.082,f=0) USER MOD Single : A 101 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 104 THR OG1 : rot -100:sc= -1.29 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 THR OG1 : rot -99:sc= 0.102 USER MOD Single : A 121 SER OG : rot 180:sc= -0.193 USER MOD Single : A 126 THR OG1 : rot 50:sc= 0.346 USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 MET CE :methyl 178:sc= -1.45 (180deg=-1.52) USER MOD Single : A 132 ASN : amide:sc= -0.816 K(o=-0.82,f=-0.058) USER MOD Single : A 137 THR OG1 : rot 180:sc= -0.114 USER MOD Single : A 138 LYS NZ :NH3+ 140:sc= 0.515 (180deg=0.0157) USER MOD Single : A 140 SER OG : rot 13:sc= 0.301 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 THR OG1 : rot 180:sc= 0.0577 USER MOD Single : A 148 ASN : amide:sc= -1.65 K(o=-1.7,f=-5.3!) USER MOD Single : A 152 THR OG1 : rot 113:sc= 0.944 USER MOD Single : A 154 THR OG1 : rot 180:sc= -0.152 USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 -3.580 6.382 4.159 1.00 0.00 N ATOM 2 CA THR A 1 -3.582 5.134 3.345 1.00 0.00 C ATOM 3 C THR A 1 -2.175 4.530 3.335 1.00 0.00 C ATOM 4 O THR A 1 -1.203 5.197 3.635 1.00 0.00 O ATOM 5 CB THR A 1 -4.005 5.460 1.911 1.00 0.00 C ATOM 6 OG1 THR A 1 -5.131 6.327 1.938 1.00 0.00 O ATOM 7 CG2 THR A 1 -4.370 4.168 1.177 1.00 0.00 C ATOM 0 H1 THR A 1 -4.430 6.940 3.940 1.00 0.00 H new ATOM 0 H2 THR A 1 -3.577 6.137 5.170 1.00 0.00 H new ATOM 0 H3 THR A 1 -2.732 6.941 3.936 1.00 0.00 H new ATOM 0 HA THR A 1 -4.283 4.420 3.777 1.00 0.00 H new ATOM 0 HB THR A 1 -3.181 5.949 1.391 1.00 0.00 H new ATOM 0 HG1 THR A 1 -5.038 7.005 1.237 1.00 0.00 H new ATOM 0 HG21 THR A 1 -4.671 4.402 0.156 1.00 0.00 H new ATOM 0 HG22 THR A 1 -3.506 3.504 1.157 1.00 0.00 H new ATOM 0 HG23 THR A 1 -5.194 3.676 1.694 1.00 0.00 H new ATOM 17 N ALA A 2 -2.064 3.272 2.992 1.00 0.00 N ATOM 18 CA ALA A 2 -0.725 2.614 2.961 1.00 0.00 C ATOM 19 C ALA A 2 -0.566 1.843 1.649 1.00 0.00 C ATOM 20 O ALA A 2 -1.455 1.126 1.231 1.00 0.00 O ATOM 21 CB ALA A 2 -0.604 1.646 4.139 1.00 0.00 C ATOM 0 H ALA A 2 -2.846 2.671 2.731 1.00 0.00 H new ATOM 0 HA ALA A 2 0.054 3.373 3.034 1.00 0.00 H new ATOM 0 HB1 ALA A 2 0.374 1.166 4.116 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -0.717 2.195 5.074 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -1.383 0.887 4.068 1.00 0.00 H new ATOM 27 N PHE A 3 0.562 1.987 1.000 1.00 0.00 N ATOM 28 CA PHE A 3 0.789 1.266 -0.287 1.00 0.00 C ATOM 29 C PHE A 3 1.742 0.091 -0.050 1.00 0.00 C ATOM 30 O PHE A 3 2.545 0.106 0.864 1.00 0.00 O ATOM 31 CB PHE A 3 1.407 2.224 -1.308 1.00 0.00 C ATOM 32 CG PHE A 3 0.318 3.048 -1.952 1.00 0.00 C ATOM 33 CD1 PHE A 3 -0.546 3.812 -1.159 1.00 0.00 C ATOM 34 CD2 PHE A 3 0.176 3.050 -3.345 1.00 0.00 C ATOM 35 CE1 PHE A 3 -1.554 4.577 -1.759 1.00 0.00 C ATOM 36 CE2 PHE A 3 -0.832 3.815 -3.945 1.00 0.00 C ATOM 37 CZ PHE A 3 -1.697 4.579 -3.152 1.00 0.00 C ATOM 0 H PHE A 3 1.337 2.575 1.308 1.00 0.00 H new ATOM 0 HA PHE A 3 -0.162 0.894 -0.668 1.00 0.00 H new ATOM 0 HB2 PHE A 3 2.130 2.877 -0.818 1.00 0.00 H new ATOM 0 HB3 PHE A 3 1.949 1.661 -2.068 1.00 0.00 H new ATOM 0 HD1 PHE A 3 -0.435 3.812 -0.085 1.00 0.00 H new ATOM 0 HD2 PHE A 3 0.844 2.462 -3.957 1.00 0.00 H new ATOM 0 HE1 PHE A 3 -2.221 5.166 -1.147 1.00 0.00 H new ATOM 0 HE2 PHE A 3 -0.942 3.816 -5.019 1.00 0.00 H new ATOM 0 HZ PHE A 3 -2.474 5.169 -3.614 1.00 0.00 H new ATOM 47 N LEU A 4 1.656 -0.925 -0.871 1.00 0.00 N ATOM 48 CA LEU A 4 2.552 -2.108 -0.706 1.00 0.00 C ATOM 49 C LEU A 4 2.519 -2.950 -1.983 1.00 0.00 C ATOM 50 O LEU A 4 1.528 -3.587 -2.288 1.00 0.00 O ATOM 51 CB LEU A 4 2.070 -2.951 0.477 1.00 0.00 C ATOM 52 CG LEU A 4 3.062 -4.088 0.734 1.00 0.00 C ATOM 53 CD1 LEU A 4 4.180 -3.593 1.652 1.00 0.00 C ATOM 54 CD2 LEU A 4 2.333 -5.255 1.404 1.00 0.00 C ATOM 0 H LEU A 4 1.001 -0.985 -1.651 1.00 0.00 H new ATOM 0 HA LEU A 4 3.572 -1.772 -0.518 1.00 0.00 H new ATOM 0 HB2 LEU A 4 1.977 -2.328 1.367 1.00 0.00 H new ATOM 0 HB3 LEU A 4 1.081 -3.358 0.268 1.00 0.00 H new ATOM 0 HG LEU A 4 3.490 -4.419 -0.213 1.00 0.00 H new ATOM 0 HD11 LEU A 4 4.886 -4.403 1.835 1.00 0.00 H new ATOM 0 HD12 LEU A 4 4.698 -2.760 1.177 1.00 0.00 H new ATOM 0 HD13 LEU A 4 3.754 -3.263 2.599 1.00 0.00 H new ATOM 0 HD21 LEU A 4 3.037 -6.066 1.588 1.00 0.00 H new ATOM 0 HD22 LEU A 4 1.907 -4.923 2.351 1.00 0.00 H new ATOM 0 HD23 LEU A 4 1.535 -5.609 0.751 1.00 0.00 H new ATOM 66 N TRP A 5 3.593 -2.954 -2.732 1.00 0.00 N ATOM 67 CA TRP A 5 3.627 -3.751 -3.992 1.00 0.00 C ATOM 68 C TRP A 5 5.017 -4.374 -4.171 1.00 0.00 C ATOM 69 O TRP A 5 6.018 -3.795 -3.793 1.00 0.00 O ATOM 70 CB TRP A 5 3.296 -2.838 -5.184 1.00 0.00 C ATOM 71 CG TRP A 5 4.318 -1.746 -5.306 1.00 0.00 C ATOM 72 CD1 TRP A 5 5.244 -1.663 -6.290 1.00 0.00 C ATOM 73 CD2 TRP A 5 4.536 -0.592 -4.441 1.00 0.00 C ATOM 74 NE1 TRP A 5 6.015 -0.533 -6.084 1.00 0.00 N ATOM 75 CE2 TRP A 5 5.618 0.159 -4.958 1.00 0.00 C ATOM 76 CE3 TRP A 5 3.907 -0.128 -3.270 1.00 0.00 C ATOM 77 CZ2 TRP A 5 6.061 1.328 -4.337 1.00 0.00 C ATOM 78 CZ3 TRP A 5 4.352 1.048 -2.643 1.00 0.00 C ATOM 79 CH2 TRP A 5 5.426 1.774 -3.176 1.00 0.00 C ATOM 0 H TRP A 5 4.448 -2.438 -2.523 1.00 0.00 H new ATOM 0 HA TRP A 5 2.887 -4.550 -3.940 1.00 0.00 H new ATOM 0 HB2 TRP A 5 3.269 -3.424 -6.103 1.00 0.00 H new ATOM 0 HB3 TRP A 5 2.305 -2.404 -5.054 1.00 0.00 H new ATOM 0 HD1 TRP A 5 5.362 -2.364 -7.103 1.00 0.00 H new ATOM 0 HE1 TRP A 5 6.783 -0.246 -6.691 1.00 0.00 H new ATOM 0 HE3 TRP A 5 3.078 -0.679 -2.851 1.00 0.00 H new ATOM 0 HZ2 TRP A 5 6.889 1.884 -4.752 1.00 0.00 H new ATOM 0 HZ3 TRP A 5 3.863 1.395 -1.744 1.00 0.00 H new ATOM 0 HH2 TRP A 5 5.762 2.678 -2.689 1.00 0.00 H new ATOM 90 N ALA A 6 5.080 -5.547 -4.749 1.00 0.00 N ATOM 91 CA ALA A 6 6.399 -6.213 -4.960 1.00 0.00 C ATOM 92 C ALA A 6 6.872 -5.955 -6.392 1.00 0.00 C ATOM 93 O ALA A 6 6.310 -6.469 -7.341 1.00 0.00 O ATOM 94 CB ALA A 6 6.252 -7.719 -4.733 1.00 0.00 C ATOM 0 H ALA A 6 4.272 -6.072 -5.084 1.00 0.00 H new ATOM 0 HA ALA A 6 7.129 -5.811 -4.257 1.00 0.00 H new ATOM 0 HB1 ALA A 6 7.215 -8.206 -4.887 1.00 0.00 H new ATOM 0 HB2 ALA A 6 5.912 -7.902 -3.714 1.00 0.00 H new ATOM 0 HB3 ALA A 6 5.524 -8.124 -5.436 1.00 0.00 H new ATOM 100 N GLN A 7 7.899 -5.159 -6.552 1.00 0.00 N ATOM 101 CA GLN A 7 8.413 -4.860 -7.921 1.00 0.00 C ATOM 102 C GLN A 7 9.923 -5.100 -7.967 1.00 0.00 C ATOM 103 O GLN A 7 10.617 -4.931 -6.982 1.00 0.00 O ATOM 104 CB GLN A 7 8.119 -3.399 -8.267 1.00 0.00 C ATOM 105 CG GLN A 7 8.682 -2.489 -7.172 1.00 0.00 C ATOM 106 CD GLN A 7 8.846 -1.071 -7.721 1.00 0.00 C ATOM 107 OE1 GLN A 7 7.873 -0.391 -7.980 1.00 0.00 O ATOM 108 NE2 GLN A 7 10.045 -0.592 -7.909 1.00 0.00 N ATOM 0 H GLN A 7 8.404 -4.703 -5.792 1.00 0.00 H new ATOM 0 HA GLN A 7 7.921 -5.512 -8.642 1.00 0.00 H new ATOM 0 HB2 GLN A 7 8.564 -3.146 -9.229 1.00 0.00 H new ATOM 0 HB3 GLN A 7 7.044 -3.247 -8.363 1.00 0.00 H new ATOM 0 HG2 GLN A 7 8.014 -2.482 -6.311 1.00 0.00 H new ATOM 0 HG3 GLN A 7 9.643 -2.870 -6.826 1.00 0.00 H new ATOM 0 HE21 GLN A 7 10.862 -1.163 -7.692 1.00 0.00 H new ATOM 0 HE22 GLN A 7 10.165 0.353 -8.273 1.00 0.00 H new ATOM 117 N ASP A 8 10.435 -5.490 -9.108 1.00 0.00 N ATOM 118 CA ASP A 8 11.902 -5.742 -9.231 1.00 0.00 C ATOM 119 C ASP A 8 12.575 -4.526 -9.872 1.00 0.00 C ATOM 120 O ASP A 8 11.915 -3.614 -10.334 1.00 0.00 O ATOM 121 CB ASP A 8 12.142 -6.980 -10.102 1.00 0.00 C ATOM 122 CG ASP A 8 11.351 -6.864 -11.410 1.00 0.00 C ATOM 123 OD1 ASP A 8 11.158 -5.751 -11.868 1.00 0.00 O ATOM 124 OD2 ASP A 8 10.954 -7.893 -11.930 1.00 0.00 O ATOM 0 H ASP A 8 9.898 -5.645 -9.961 1.00 0.00 H new ATOM 0 HA ASP A 8 12.324 -5.912 -8.241 1.00 0.00 H new ATOM 0 HB2 ASP A 8 13.205 -7.081 -10.319 1.00 0.00 H new ATOM 0 HB3 ASP A 8 11.839 -7.878 -9.563 1.00 0.00 H new ATOM 129 N ARG A 9 13.883 -4.511 -9.903 1.00 0.00 N ATOM 130 CA ARG A 9 14.612 -3.357 -10.513 1.00 0.00 C ATOM 131 C ARG A 9 14.246 -3.237 -11.995 1.00 0.00 C ATOM 132 O ARG A 9 14.426 -2.199 -12.603 1.00 0.00 O ATOM 133 CB ARG A 9 16.120 -3.580 -10.378 1.00 0.00 C ATOM 134 CG ARG A 9 16.490 -4.943 -10.963 1.00 0.00 C ATOM 135 CD ARG A 9 17.995 -4.993 -11.233 1.00 0.00 C ATOM 136 NE ARG A 9 18.728 -5.172 -9.940 1.00 0.00 N ATOM 137 CZ ARG A 9 19.097 -4.134 -9.221 1.00 0.00 C ATOM 138 NH1 ARG A 9 18.834 -2.913 -9.616 1.00 0.00 N ATOM 139 NH2 ARG A 9 19.733 -4.323 -8.098 1.00 0.00 N ATOM 0 H ARG A 9 14.480 -5.250 -9.531 1.00 0.00 H new ATOM 0 HA ARG A 9 14.329 -2.439 -9.997 1.00 0.00 H new ATOM 0 HB2 ARG A 9 16.663 -2.790 -10.898 1.00 0.00 H new ATOM 0 HB3 ARG A 9 16.413 -3.531 -9.329 1.00 0.00 H new ATOM 0 HG2 ARG A 9 16.208 -5.736 -10.271 1.00 0.00 H new ATOM 0 HG3 ARG A 9 15.938 -5.115 -11.887 1.00 0.00 H new ATOM 0 HD2 ARG A 9 18.227 -5.814 -11.911 1.00 0.00 H new ATOM 0 HD3 ARG A 9 18.318 -4.074 -11.723 1.00 0.00 H new ATOM 0 HE ARG A 9 18.945 -6.113 -9.612 1.00 0.00 H new ATOM 0 HH11 ARG A 9 18.336 -2.757 -10.492 1.00 0.00 H new ATOM 0 HH12 ARG A 9 19.127 -2.119 -9.047 1.00 0.00 H new ATOM 0 HH21 ARG A 9 19.941 -5.271 -7.783 1.00 0.00 H new ATOM 0 HH22 ARG A 9 20.022 -3.523 -7.535 1.00 0.00 H new ATOM 153 N ASP A 10 13.735 -4.292 -12.579 1.00 0.00 N ATOM 154 CA ASP A 10 13.357 -4.246 -14.023 1.00 0.00 C ATOM 155 C ASP A 10 12.027 -3.502 -14.188 1.00 0.00 C ATOM 156 O ASP A 10 11.388 -3.581 -15.221 1.00 0.00 O ATOM 157 CB ASP A 10 13.211 -5.672 -14.557 1.00 0.00 C ATOM 158 CG ASP A 10 14.594 -6.242 -14.876 1.00 0.00 C ATOM 159 OD1 ASP A 10 15.369 -6.418 -13.950 1.00 0.00 O ATOM 160 OD2 ASP A 10 14.855 -6.493 -16.041 1.00 0.00 O ATOM 0 H ASP A 10 13.563 -5.185 -12.116 1.00 0.00 H new ATOM 0 HA ASP A 10 14.134 -3.723 -14.581 1.00 0.00 H new ATOM 0 HB2 ASP A 10 12.709 -6.298 -13.819 1.00 0.00 H new ATOM 0 HB3 ASP A 10 12.590 -5.674 -15.453 1.00 0.00 H new ATOM 165 N GLY A 11 11.605 -2.780 -13.179 1.00 0.00 N ATOM 166 CA GLY A 11 10.318 -2.029 -13.270 1.00 0.00 C ATOM 167 C GLY A 11 9.162 -3.011 -13.464 1.00 0.00 C ATOM 168 O GLY A 11 8.219 -2.738 -14.183 1.00 0.00 O ATOM 0 H GLY A 11 12.100 -2.679 -12.293 1.00 0.00 H new ATOM 0 HA2 GLY A 11 10.162 -1.443 -12.364 1.00 0.00 H new ATOM 0 HA3 GLY A 11 10.354 -1.326 -14.102 1.00 0.00 H new ATOM 172 N LEU A 12 9.230 -4.154 -12.828 1.00 0.00 N ATOM 173 CA LEU A 12 8.138 -5.162 -12.970 1.00 0.00 C ATOM 174 C LEU A 12 7.293 -5.181 -11.695 1.00 0.00 C ATOM 175 O LEU A 12 7.669 -4.620 -10.684 1.00 0.00 O ATOM 176 CB LEU A 12 8.750 -6.546 -13.197 1.00 0.00 C ATOM 177 CG LEU A 12 7.804 -7.387 -14.056 1.00 0.00 C ATOM 178 CD1 LEU A 12 7.902 -6.939 -15.514 1.00 0.00 C ATOM 179 CD2 LEU A 12 8.197 -8.863 -13.949 1.00 0.00 C ATOM 0 H LEU A 12 9.997 -4.432 -12.216 1.00 0.00 H new ATOM 0 HA LEU A 12 7.508 -4.899 -13.819 1.00 0.00 H new ATOM 0 HB2 LEU A 12 9.718 -6.451 -13.689 1.00 0.00 H new ATOM 0 HB3 LEU A 12 8.926 -7.039 -12.241 1.00 0.00 H new ATOM 0 HG LEU A 12 6.781 -7.255 -13.705 1.00 0.00 H new ATOM 0 HD11 LEU A 12 7.228 -7.539 -16.125 1.00 0.00 H new ATOM 0 HD12 LEU A 12 7.624 -5.888 -15.591 1.00 0.00 H new ATOM 0 HD13 LEU A 12 8.925 -7.070 -15.867 1.00 0.00 H new ATOM 0 HD21 LEU A 12 7.524 -9.464 -14.560 1.00 0.00 H new ATOM 0 HD22 LEU A 12 9.220 -8.993 -14.301 1.00 0.00 H new ATOM 0 HD23 LEU A 12 8.127 -9.184 -12.910 1.00 0.00 H new ATOM 191 N ILE A 13 6.154 -5.825 -11.738 1.00 0.00 N ATOM 192 CA ILE A 13 5.276 -5.887 -10.532 1.00 0.00 C ATOM 193 C ILE A 13 4.575 -7.247 -10.480 1.00 0.00 C ATOM 194 O ILE A 13 4.204 -7.722 -9.423 1.00 0.00 O ATOM 195 CB ILE A 13 4.229 -4.772 -10.602 1.00 0.00 C ATOM 196 CG1 ILE A 13 3.446 -4.878 -11.915 1.00 0.00 C ATOM 197 CG2 ILE A 13 4.927 -3.412 -10.536 1.00 0.00 C ATOM 198 CD1 ILE A 13 2.172 -5.695 -11.685 1.00 0.00 C ATOM 0 H ILE A 13 5.794 -6.312 -12.559 1.00 0.00 H new ATOM 0 HA ILE A 13 5.882 -5.757 -9.635 1.00 0.00 H new ATOM 0 HB ILE A 13 3.541 -4.872 -9.762 1.00 0.00 H new ATOM 0 HG12 ILE A 13 3.192 -3.883 -12.280 1.00 0.00 H new ATOM 0 HG13 ILE A 13 4.061 -5.351 -12.680 1.00 0.00 H new ATOM 0 HG21 ILE A 13 4.182 -2.618 -10.586 1.00 0.00 H new ATOM 0 HG22 ILE A 13 5.480 -3.332 -9.600 1.00 0.00 H new ATOM 0 HG23 ILE A 13 5.616 -3.316 -11.375 1.00 0.00 H new ATOM 0 HD11 ILE A 13 1.615 -5.771 -12.619 1.00 0.00 H new ATOM 0 HD12 ILE A 13 2.438 -6.694 -11.339 1.00 0.00 H new ATOM 0 HD13 ILE A 13 1.555 -5.203 -10.933 1.00 0.00 H new ATOM 210 N GLY A 14 4.391 -7.874 -11.615 1.00 0.00 N ATOM 211 CA GLY A 14 3.714 -9.204 -11.641 1.00 0.00 C ATOM 212 C GLY A 14 3.837 -9.813 -13.038 1.00 0.00 C ATOM 213 O GLY A 14 4.552 -9.308 -13.883 1.00 0.00 O ATOM 0 H GLY A 14 4.682 -7.520 -12.526 1.00 0.00 H new ATOM 0 HA2 GLY A 14 4.164 -9.867 -10.903 1.00 0.00 H new ATOM 0 HA3 GLY A 14 2.663 -9.094 -11.372 1.00 0.00 H new ATOM 217 N LYS A 15 3.143 -10.896 -13.285 1.00 0.00 N ATOM 218 CA LYS A 15 3.212 -11.546 -14.626 1.00 0.00 C ATOM 219 C LYS A 15 2.176 -12.671 -14.701 1.00 0.00 C ATOM 220 O LYS A 15 2.208 -13.608 -13.928 1.00 0.00 O ATOM 221 CB LYS A 15 4.611 -12.128 -14.840 1.00 0.00 C ATOM 222 CG LYS A 15 4.763 -12.572 -16.296 1.00 0.00 C ATOM 223 CD LYS A 15 6.031 -13.416 -16.442 1.00 0.00 C ATOM 224 CE LYS A 15 6.175 -13.873 -17.895 1.00 0.00 C ATOM 225 NZ LYS A 15 7.478 -14.575 -18.069 1.00 0.00 N ATOM 0 H LYS A 15 2.531 -11.358 -12.613 1.00 0.00 H new ATOM 0 HA LYS A 15 3.004 -10.806 -15.399 1.00 0.00 H new ATOM 0 HB2 LYS A 15 5.368 -11.383 -14.595 1.00 0.00 H new ATOM 0 HB3 LYS A 15 4.770 -12.975 -14.172 1.00 0.00 H new ATOM 0 HG2 LYS A 15 3.891 -13.149 -16.604 1.00 0.00 H new ATOM 0 HG3 LYS A 15 4.816 -11.701 -16.949 1.00 0.00 H new ATOM 0 HD2 LYS A 15 6.904 -12.835 -16.144 1.00 0.00 H new ATOM 0 HD3 LYS A 15 5.983 -14.281 -15.781 1.00 0.00 H new ATOM 0 HE2 LYS A 15 5.353 -14.538 -18.161 1.00 0.00 H new ATOM 0 HE3 LYS A 15 6.120 -13.015 -18.564 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 7.576 -14.886 -19.057 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 8.256 -13.927 -17.831 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 7.513 -15.403 -17.441 1.00 0.00 H new ATOM 239 N ASP A 16 1.256 -12.581 -15.631 1.00 0.00 N ATOM 240 CA ASP A 16 0.208 -13.638 -15.770 1.00 0.00 C ATOM 241 C ASP A 16 -0.601 -13.737 -14.473 1.00 0.00 C ATOM 242 O ASP A 16 -1.048 -14.802 -14.092 1.00 0.00 O ATOM 243 CB ASP A 16 0.873 -14.988 -16.062 1.00 0.00 C ATOM 244 CG ASP A 16 0.915 -15.220 -17.574 1.00 0.00 C ATOM 245 OD1 ASP A 16 1.702 -14.560 -18.233 1.00 0.00 O ATOM 246 OD2 ASP A 16 0.159 -16.053 -18.047 1.00 0.00 O ATOM 0 H ASP A 16 1.187 -11.816 -16.303 1.00 0.00 H new ATOM 0 HA ASP A 16 -0.458 -13.377 -16.592 1.00 0.00 H new ATOM 0 HB2 ASP A 16 1.883 -15.004 -15.653 1.00 0.00 H new ATOM 0 HB3 ASP A 16 0.319 -15.791 -15.575 1.00 0.00 H new ATOM 251 N GLY A 17 -0.791 -12.633 -13.797 1.00 0.00 N ATOM 252 CA GLY A 17 -1.569 -12.651 -12.524 1.00 0.00 C ATOM 253 C GLY A 17 -0.628 -12.927 -11.351 1.00 0.00 C ATOM 254 O GLY A 17 -0.478 -12.112 -10.460 1.00 0.00 O ATOM 0 H GLY A 17 -0.439 -11.717 -14.074 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -2.074 -11.696 -12.381 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -2.343 -13.417 -12.570 1.00 0.00 H new ATOM 258 N HIS A 18 0.007 -14.072 -11.345 1.00 0.00 N ATOM 259 CA HIS A 18 0.943 -14.411 -10.233 1.00 0.00 C ATOM 260 C HIS A 18 2.262 -13.661 -10.431 1.00 0.00 C ATOM 261 O HIS A 18 2.439 -12.946 -11.399 1.00 0.00 O ATOM 262 CB HIS A 18 1.205 -15.920 -10.226 1.00 0.00 C ATOM 263 CG HIS A 18 1.677 -16.359 -11.586 1.00 0.00 C ATOM 264 ND1 HIS A 18 3.022 -16.429 -11.914 1.00 0.00 N ATOM 265 CD2 HIS A 18 0.996 -16.753 -12.711 1.00 0.00 C ATOM 266 CE1 HIS A 18 3.108 -16.851 -13.189 1.00 0.00 C ATOM 267 NE2 HIS A 18 1.902 -17.063 -13.722 1.00 0.00 N ATOM 0 H HIS A 18 -0.084 -14.788 -12.066 1.00 0.00 H new ATOM 0 HA HIS A 18 0.499 -14.118 -9.282 1.00 0.00 H new ATOM 0 HB2 HIS A 18 1.955 -16.165 -9.474 1.00 0.00 H new ATOM 0 HB3 HIS A 18 0.295 -16.456 -9.956 1.00 0.00 H new ATOM 0 HD1 HIS A 18 3.804 -16.202 -11.300 1.00 0.00 H new ATOM 0 HD2 HIS A 18 -0.079 -16.813 -12.799 1.00 0.00 H new ATOM 0 HE1 HIS A 18 4.038 -17.000 -13.717 1.00 0.00 H new ATOM 275 N LEU A 19 3.187 -13.821 -9.518 1.00 0.00 N ATOM 276 CA LEU A 19 4.499 -13.121 -9.646 1.00 0.00 C ATOM 277 C LEU A 19 5.428 -13.937 -10.557 1.00 0.00 C ATOM 278 O LEU A 19 5.260 -15.133 -10.684 1.00 0.00 O ATOM 279 CB LEU A 19 5.137 -12.979 -8.263 1.00 0.00 C ATOM 280 CG LEU A 19 4.528 -11.777 -7.540 1.00 0.00 C ATOM 281 CD1 LEU A 19 4.830 -11.874 -6.043 1.00 0.00 C ATOM 282 CD2 LEU A 19 5.132 -10.487 -8.098 1.00 0.00 C ATOM 0 H LEU A 19 3.089 -14.407 -8.689 1.00 0.00 H new ATOM 0 HA LEU A 19 4.343 -12.133 -10.078 1.00 0.00 H new ATOM 0 HB2 LEU A 19 4.975 -13.887 -7.681 1.00 0.00 H new ATOM 0 HB3 LEU A 19 6.215 -12.850 -8.360 1.00 0.00 H new ATOM 0 HG LEU A 19 3.449 -11.770 -7.693 1.00 0.00 H new ATOM 0 HD11 LEU A 19 4.396 -11.017 -5.528 1.00 0.00 H new ATOM 0 HD12 LEU A 19 4.401 -12.793 -5.644 1.00 0.00 H new ATOM 0 HD13 LEU A 19 5.909 -11.881 -5.889 1.00 0.00 H new ATOM 0 HD21 LEU A 19 4.698 -9.630 -7.583 1.00 0.00 H new ATOM 0 HD22 LEU A 19 6.211 -10.495 -7.945 1.00 0.00 H new ATOM 0 HD23 LEU A 19 4.917 -10.416 -9.164 1.00 0.00 H new ATOM 294 N PRO A 20 6.388 -13.272 -11.169 1.00 0.00 N ATOM 295 CA PRO A 20 7.400 -13.880 -12.099 1.00 0.00 C ATOM 296 C PRO A 20 8.514 -14.551 -11.290 1.00 0.00 C ATOM 297 O PRO A 20 9.101 -15.527 -11.717 1.00 0.00 O ATOM 298 CB PRO A 20 7.968 -12.734 -12.933 1.00 0.00 C ATOM 299 CG PRO A 20 7.550 -11.438 -12.270 1.00 0.00 C ATOM 300 CD PRO A 20 6.673 -11.793 -11.074 1.00 0.00 C ATOM 0 HA PRO A 20 6.948 -14.640 -12.736 1.00 0.00 H new ATOM 0 HB2 PRO A 20 9.054 -12.803 -12.990 1.00 0.00 H new ATOM 0 HB3 PRO A 20 7.592 -12.781 -13.955 1.00 0.00 H new ATOM 0 HG2 PRO A 20 8.425 -10.873 -11.949 1.00 0.00 H new ATOM 0 HG3 PRO A 20 7.004 -10.808 -12.972 1.00 0.00 H new ATOM 0 HD2 PRO A 20 7.180 -11.556 -10.139 1.00 0.00 H new ATOM 0 HD3 PRO A 20 5.747 -11.219 -11.089 1.00 0.00 H new ATOM 308 N TRP A 21 8.807 -14.031 -10.125 1.00 0.00 N ATOM 309 CA TRP A 21 9.883 -14.630 -9.280 1.00 0.00 C ATOM 310 C TRP A 21 9.252 -15.391 -8.111 1.00 0.00 C ATOM 311 O TRP A 21 8.070 -15.270 -7.847 1.00 0.00 O ATOM 312 CB TRP A 21 10.789 -13.519 -8.739 1.00 0.00 C ATOM 313 CG TRP A 21 9.962 -12.486 -8.038 1.00 0.00 C ATOM 314 CD1 TRP A 21 9.508 -12.587 -6.769 1.00 0.00 C ATOM 315 CD2 TRP A 21 9.486 -11.206 -8.544 1.00 0.00 C ATOM 316 NE1 TRP A 21 8.782 -11.450 -6.462 1.00 0.00 N ATOM 317 CE2 TRP A 21 8.740 -10.569 -7.524 1.00 0.00 C ATOM 318 CE3 TRP A 21 9.626 -10.540 -9.776 1.00 0.00 C ATOM 319 CZ2 TRP A 21 8.155 -9.317 -7.719 1.00 0.00 C ATOM 320 CZ3 TRP A 21 9.039 -9.281 -9.975 1.00 0.00 C ATOM 321 CH2 TRP A 21 8.304 -8.670 -8.949 1.00 0.00 C ATOM 0 H TRP A 21 8.346 -13.215 -9.722 1.00 0.00 H new ATOM 0 HA TRP A 21 10.475 -15.318 -9.883 1.00 0.00 H new ATOM 0 HB2 TRP A 21 11.523 -13.939 -8.051 1.00 0.00 H new ATOM 0 HB3 TRP A 21 11.345 -13.060 -9.557 1.00 0.00 H new ATOM 0 HD1 TRP A 21 9.683 -13.419 -6.103 1.00 0.00 H new ATOM 0 HE1 TRP A 21 8.333 -11.283 -5.562 1.00 0.00 H new ATOM 0 HE3 TRP A 21 10.189 -11.001 -10.574 1.00 0.00 H new ATOM 0 HZ2 TRP A 21 7.591 -8.851 -6.925 1.00 0.00 H new ATOM 0 HZ3 TRP A 21 9.154 -8.779 -10.925 1.00 0.00 H new ATOM 0 HH2 TRP A 21 7.854 -7.701 -9.109 1.00 0.00 H new ATOM 332 N HIS A 22 10.035 -16.172 -7.411 1.00 0.00 N ATOM 333 CA HIS A 22 9.491 -16.946 -6.256 1.00 0.00 C ATOM 334 C HIS A 22 10.142 -16.452 -4.962 1.00 0.00 C ATOM 335 O HIS A 22 11.301 -16.712 -4.702 1.00 0.00 O ATOM 336 CB HIS A 22 9.801 -18.431 -6.447 1.00 0.00 C ATOM 337 CG HIS A 22 8.934 -19.246 -5.527 1.00 0.00 C ATOM 338 ND1 HIS A 22 7.550 -19.222 -5.601 1.00 0.00 N ATOM 339 CD2 HIS A 22 9.239 -20.111 -4.505 1.00 0.00 C ATOM 340 CE1 HIS A 22 7.079 -20.050 -4.650 1.00 0.00 C ATOM 341 NE2 HIS A 22 8.067 -20.618 -3.953 1.00 0.00 N ATOM 0 H HIS A 22 11.030 -16.307 -7.591 1.00 0.00 H new ATOM 0 HA HIS A 22 8.412 -16.805 -6.198 1.00 0.00 H new ATOM 0 HB2 HIS A 22 9.623 -18.720 -7.483 1.00 0.00 H new ATOM 0 HB3 HIS A 22 10.853 -18.624 -6.238 1.00 0.00 H new ATOM 0 HD2 HIS A 22 10.238 -20.360 -4.179 1.00 0.00 H new ATOM 0 HE1 HIS A 22 6.030 -20.233 -4.472 1.00 0.00 H new ATOM 0 HE2 HIS A 22 7.981 -21.281 -3.182 1.00 0.00 H new ATOM 349 N LEU A 23 9.399 -15.742 -4.149 1.00 0.00 N ATOM 350 CA LEU A 23 9.966 -15.226 -2.868 1.00 0.00 C ATOM 351 C LEU A 23 9.027 -15.597 -1.707 1.00 0.00 C ATOM 352 O LEU A 23 8.247 -14.776 -1.264 1.00 0.00 O ATOM 353 CB LEU A 23 10.109 -13.704 -2.952 1.00 0.00 C ATOM 354 CG LEU A 23 11.162 -13.231 -1.947 1.00 0.00 C ATOM 355 CD1 LEU A 23 12.534 -13.779 -2.346 1.00 0.00 C ATOM 356 CD2 LEU A 23 11.208 -11.700 -1.941 1.00 0.00 C ATOM 0 H LEU A 23 8.423 -15.498 -4.319 1.00 0.00 H new ATOM 0 HA LEU A 23 10.946 -15.671 -2.695 1.00 0.00 H new ATOM 0 HB2 LEU A 23 10.398 -13.411 -3.961 1.00 0.00 H new ATOM 0 HB3 LEU A 23 9.152 -13.227 -2.743 1.00 0.00 H new ATOM 0 HG LEU A 23 10.902 -13.593 -0.952 1.00 0.00 H new ATOM 0 HD11 LEU A 23 13.283 -13.441 -1.630 1.00 0.00 H new ATOM 0 HD12 LEU A 23 12.503 -14.869 -2.352 1.00 0.00 H new ATOM 0 HD13 LEU A 23 12.795 -13.418 -3.341 1.00 0.00 H new ATOM 0 HD21 LEU A 23 11.957 -11.361 -1.226 1.00 0.00 H new ATOM 0 HD22 LEU A 23 11.468 -11.340 -2.936 1.00 0.00 H new ATOM 0 HD23 LEU A 23 10.232 -11.308 -1.657 1.00 0.00 H new ATOM 368 N PRO A 24 9.126 -16.828 -1.242 1.00 0.00 N ATOM 369 CA PRO A 24 8.306 -17.398 -0.113 1.00 0.00 C ATOM 370 C PRO A 24 8.244 -16.403 1.052 1.00 0.00 C ATOM 371 O PRO A 24 7.215 -16.237 1.681 1.00 0.00 O ATOM 372 CB PRO A 24 8.996 -18.687 0.330 1.00 0.00 C ATOM 373 CG PRO A 24 10.095 -18.989 -0.667 1.00 0.00 C ATOM 374 CD PRO A 24 10.062 -17.902 -1.735 1.00 0.00 C ATOM 0 HA PRO A 24 7.283 -17.594 -0.435 1.00 0.00 H new ATOM 0 HB2 PRO A 24 9.410 -18.574 1.332 1.00 0.00 H new ATOM 0 HB3 PRO A 24 8.281 -19.509 0.371 1.00 0.00 H new ATOM 0 HG2 PRO A 24 11.066 -19.009 -0.172 1.00 0.00 H new ATOM 0 HG3 PRO A 24 9.945 -19.971 -1.116 1.00 0.00 H new ATOM 0 HD2 PRO A 24 11.060 -17.496 -1.903 1.00 0.00 H new ATOM 0 HD3 PRO A 24 9.718 -18.307 -2.687 1.00 0.00 H new ATOM 382 N ASP A 25 9.337 -15.746 1.343 1.00 0.00 N ATOM 383 CA ASP A 25 9.353 -14.762 2.466 1.00 0.00 C ATOM 384 C ASP A 25 8.378 -13.624 2.163 1.00 0.00 C ATOM 385 O ASP A 25 7.554 -13.267 2.985 1.00 0.00 O ATOM 386 CB ASP A 25 10.765 -14.195 2.626 1.00 0.00 C ATOM 387 CG ASP A 25 10.961 -13.711 4.064 1.00 0.00 C ATOM 388 OD1 ASP A 25 11.140 -14.550 4.932 1.00 0.00 O ATOM 389 OD2 ASP A 25 10.929 -12.509 4.273 1.00 0.00 O ATOM 0 H ASP A 25 10.223 -15.849 0.849 1.00 0.00 H new ATOM 0 HA ASP A 25 9.054 -15.259 3.389 1.00 0.00 H new ATOM 0 HB2 ASP A 25 11.504 -14.958 2.384 1.00 0.00 H new ATOM 0 HB3 ASP A 25 10.918 -13.371 1.930 1.00 0.00 H new ATOM 394 N ASP A 26 8.465 -13.052 0.988 1.00 0.00 N ATOM 395 CA ASP A 26 7.546 -11.935 0.621 1.00 0.00 C ATOM 396 C ASP A 26 6.103 -12.444 0.606 1.00 0.00 C ATOM 397 O ASP A 26 5.175 -11.713 0.894 1.00 0.00 O ATOM 398 CB ASP A 26 7.919 -11.404 -0.766 1.00 0.00 C ATOM 399 CG ASP A 26 7.058 -10.184 -1.099 1.00 0.00 C ATOM 400 OD1 ASP A 26 6.746 -9.436 -0.187 1.00 0.00 O ATOM 401 OD2 ASP A 26 6.722 -10.020 -2.261 1.00 0.00 O ATOM 0 H ASP A 26 9.136 -13.313 0.266 1.00 0.00 H new ATOM 0 HA ASP A 26 7.637 -11.132 1.353 1.00 0.00 H new ATOM 0 HB2 ASP A 26 8.975 -11.134 -0.791 1.00 0.00 H new ATOM 0 HB3 ASP A 26 7.771 -12.181 -1.516 1.00 0.00 H new ATOM 406 N LEU A 27 5.911 -13.695 0.271 1.00 0.00 N ATOM 407 CA LEU A 27 4.531 -14.261 0.234 1.00 0.00 C ATOM 408 C LEU A 27 4.013 -14.438 1.662 1.00 0.00 C ATOM 409 O LEU A 27 2.820 -14.449 1.902 1.00 0.00 O ATOM 410 CB LEU A 27 4.554 -15.619 -0.473 1.00 0.00 C ATOM 411 CG LEU A 27 4.983 -15.430 -1.930 1.00 0.00 C ATOM 412 CD1 LEU A 27 5.133 -16.799 -2.599 1.00 0.00 C ATOM 413 CD2 LEU A 27 3.923 -14.613 -2.675 1.00 0.00 C ATOM 0 H LEU A 27 6.653 -14.349 0.021 1.00 0.00 H new ATOM 0 HA LEU A 27 3.875 -13.581 -0.308 1.00 0.00 H new ATOM 0 HB2 LEU A 27 5.243 -16.294 0.035 1.00 0.00 H new ATOM 0 HB3 LEU A 27 3.567 -16.080 -0.430 1.00 0.00 H new ATOM 0 HG LEU A 27 5.936 -14.902 -1.961 1.00 0.00 H new ATOM 0 HD11 LEU A 27 5.438 -16.665 -3.637 1.00 0.00 H new ATOM 0 HD12 LEU A 27 5.888 -17.381 -2.071 1.00 0.00 H new ATOM 0 HD13 LEU A 27 4.180 -17.326 -2.567 1.00 0.00 H new ATOM 0 HD21 LEU A 27 4.230 -14.479 -3.712 1.00 0.00 H new ATOM 0 HD22 LEU A 27 2.969 -15.140 -2.644 1.00 0.00 H new ATOM 0 HD23 LEU A 27 3.815 -13.638 -2.200 1.00 0.00 H new ATOM 425 N HIS A 28 4.903 -14.576 2.612 1.00 0.00 N ATOM 426 CA HIS A 28 4.474 -14.752 4.030 1.00 0.00 C ATOM 427 C HIS A 28 4.273 -13.380 4.677 1.00 0.00 C ATOM 428 O HIS A 28 3.540 -13.240 5.638 1.00 0.00 O ATOM 429 CB HIS A 28 5.551 -15.524 4.797 1.00 0.00 C ATOM 430 CG HIS A 28 5.462 -16.985 4.451 1.00 0.00 C ATOM 431 ND1 HIS A 28 4.269 -17.688 4.508 1.00 0.00 N ATOM 432 CD2 HIS A 28 6.411 -17.891 4.043 1.00 0.00 C ATOM 433 CE1 HIS A 28 4.528 -18.957 4.144 1.00 0.00 C ATOM 434 NE2 HIS A 28 5.818 -19.135 3.849 1.00 0.00 N ATOM 0 H HIS A 28 5.912 -14.574 2.464 1.00 0.00 H new ATOM 0 HA HIS A 28 3.537 -15.308 4.059 1.00 0.00 H new ATOM 0 HB2 HIS A 28 6.539 -15.139 4.545 1.00 0.00 H new ATOM 0 HB3 HIS A 28 5.419 -15.385 5.870 1.00 0.00 H new ATOM 0 HD2 HIS A 28 7.458 -17.671 3.895 1.00 0.00 H new ATOM 0 HE1 HIS A 28 3.783 -19.737 4.096 1.00 0.00 H new ATOM 0 HE2 HIS A 28 6.271 -19.997 3.547 1.00 0.00 H new ATOM 442 N TYR A 29 4.919 -12.368 4.154 1.00 0.00 N ATOM 443 CA TYR A 29 4.773 -10.998 4.731 1.00 0.00 C ATOM 444 C TYR A 29 3.414 -10.419 4.332 1.00 0.00 C ATOM 445 O TYR A 29 2.879 -9.554 5.000 1.00 0.00 O ATOM 446 CB TYR A 29 5.889 -10.098 4.196 1.00 0.00 C ATOM 447 CG TYR A 29 5.964 -8.840 5.028 1.00 0.00 C ATOM 448 CD1 TYR A 29 6.178 -8.925 6.408 1.00 0.00 C ATOM 449 CD2 TYR A 29 5.819 -7.589 4.417 1.00 0.00 C ATOM 450 CE1 TYR A 29 6.247 -7.758 7.179 1.00 0.00 C ATOM 451 CE2 TYR A 29 5.888 -6.422 5.188 1.00 0.00 C ATOM 452 CZ TYR A 29 6.102 -6.506 6.568 1.00 0.00 C ATOM 453 OH TYR A 29 6.170 -5.356 7.328 1.00 0.00 O ATOM 0 H TYR A 29 5.543 -12.433 3.350 1.00 0.00 H new ATOM 0 HA TYR A 29 4.840 -11.052 5.818 1.00 0.00 H new ATOM 0 HB2 TYR A 29 6.843 -10.625 4.228 1.00 0.00 H new ATOM 0 HB3 TYR A 29 5.699 -9.846 3.153 1.00 0.00 H new ATOM 0 HD1 TYR A 29 6.290 -9.891 6.879 1.00 0.00 H new ATOM 0 HD2 TYR A 29 5.654 -7.524 3.352 1.00 0.00 H new ATOM 0 HE1 TYR A 29 6.412 -7.823 8.244 1.00 0.00 H new ATOM 0 HE2 TYR A 29 5.776 -5.457 4.717 1.00 0.00 H new ATOM 0 HH TYR A 29 6.050 -4.574 6.750 1.00 0.00 H new ATOM 463 N PHE A 30 2.856 -10.889 3.245 1.00 0.00 N ATOM 464 CA PHE A 30 1.531 -10.371 2.792 1.00 0.00 C ATOM 465 C PHE A 30 0.468 -10.699 3.844 1.00 0.00 C ATOM 466 O PHE A 30 -0.345 -9.865 4.196 1.00 0.00 O ATOM 467 CB PHE A 30 1.153 -11.029 1.464 1.00 0.00 C ATOM 468 CG PHE A 30 -0.065 -10.344 0.891 1.00 0.00 C ATOM 469 CD1 PHE A 30 0.031 -9.034 0.410 1.00 0.00 C ATOM 470 CD2 PHE A 30 -1.289 -11.021 0.841 1.00 0.00 C ATOM 471 CE1 PHE A 30 -1.098 -8.399 -0.121 1.00 0.00 C ATOM 472 CE2 PHE A 30 -2.418 -10.386 0.310 1.00 0.00 C ATOM 473 CZ PHE A 30 -2.323 -9.075 -0.171 1.00 0.00 C ATOM 0 H PHE A 30 3.263 -11.611 2.651 1.00 0.00 H new ATOM 0 HA PHE A 30 1.590 -9.291 2.659 1.00 0.00 H new ATOM 0 HB2 PHE A 30 1.985 -10.962 0.763 1.00 0.00 H new ATOM 0 HB3 PHE A 30 0.949 -12.089 1.616 1.00 0.00 H new ATOM 0 HD1 PHE A 30 0.976 -8.513 0.448 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -1.362 -12.033 1.212 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -1.024 -7.387 -0.492 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -3.363 -10.908 0.271 1.00 0.00 H new ATOM 0 HZ PHE A 30 -3.194 -8.585 -0.580 1.00 0.00 H new ATOM 483 N ARG A 31 0.471 -11.907 4.346 1.00 0.00 N ATOM 484 CA ARG A 31 -0.535 -12.299 5.375 1.00 0.00 C ATOM 485 C ARG A 31 -0.331 -11.455 6.635 1.00 0.00 C ATOM 486 O ARG A 31 -1.251 -11.236 7.401 1.00 0.00 O ATOM 487 CB ARG A 31 -0.363 -13.780 5.721 1.00 0.00 C ATOM 488 CG ARG A 31 -1.642 -14.303 6.377 1.00 0.00 C ATOM 489 CD ARG A 31 -1.314 -15.532 7.227 1.00 0.00 C ATOM 490 NE ARG A 31 -0.932 -16.669 6.332 1.00 0.00 N ATOM 491 CZ ARG A 31 -1.847 -17.443 5.790 1.00 0.00 C ATOM 492 NH1 ARG A 31 -3.121 -17.240 6.018 1.00 0.00 N ATOM 493 NH2 ARG A 31 -1.480 -18.427 5.015 1.00 0.00 N ATOM 0 H ARG A 31 1.130 -12.641 4.086 1.00 0.00 H new ATOM 0 HA ARG A 31 -1.538 -12.132 4.983 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -0.144 -14.352 4.819 1.00 0.00 H new ATOM 0 HB3 ARG A 31 0.484 -13.911 6.395 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -2.088 -13.527 6.998 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -2.376 -14.561 5.613 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -0.498 -15.306 7.914 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -2.176 -15.807 7.835 1.00 0.00 H new ATOM 0 HE ARG A 31 0.054 -16.847 6.139 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -3.415 -16.473 6.623 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -3.819 -17.849 5.590 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -0.490 -18.591 4.834 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -2.183 -19.032 4.591 1.00 0.00 H new ATOM 507 N ALA A 32 0.869 -10.981 6.853 1.00 0.00 N ATOM 508 CA ALA A 32 1.145 -10.150 8.061 1.00 0.00 C ATOM 509 C ALA A 32 0.705 -8.708 7.798 1.00 0.00 C ATOM 510 O ALA A 32 0.348 -7.985 8.709 1.00 0.00 O ATOM 511 CB ALA A 32 2.643 -10.178 8.369 1.00 0.00 C ATOM 0 H ALA A 32 1.672 -11.135 6.243 1.00 0.00 H new ATOM 0 HA ALA A 32 0.593 -10.550 8.911 1.00 0.00 H new ATOM 0 HB1 ALA A 32 2.844 -9.571 9.252 1.00 0.00 H new ATOM 0 HB2 ALA A 32 2.957 -11.205 8.556 1.00 0.00 H new ATOM 0 HB3 ALA A 32 3.197 -9.778 7.519 1.00 0.00 H new ATOM 517 N GLN A 33 0.730 -8.288 6.559 1.00 0.00 N ATOM 518 CA GLN A 33 0.314 -6.894 6.225 1.00 0.00 C ATOM 519 C GLN A 33 -1.091 -6.911 5.621 1.00 0.00 C ATOM 520 O GLN A 33 -1.413 -6.119 4.755 1.00 0.00 O ATOM 521 CB GLN A 33 1.297 -6.298 5.215 1.00 0.00 C ATOM 522 CG GLN A 33 2.649 -6.066 5.891 1.00 0.00 C ATOM 523 CD GLN A 33 2.592 -4.785 6.724 1.00 0.00 C ATOM 524 OE1 GLN A 33 2.890 -4.799 7.902 1.00 0.00 O ATOM 525 NE2 GLN A 33 2.218 -3.669 6.159 1.00 0.00 N ATOM 0 H GLN A 33 1.022 -8.853 5.762 1.00 0.00 H new ATOM 0 HA GLN A 33 0.311 -6.288 7.131 1.00 0.00 H new ATOM 0 HB2 GLN A 33 1.414 -6.971 4.366 1.00 0.00 H new ATOM 0 HB3 GLN A 33 0.908 -5.358 4.825 1.00 0.00 H new ATOM 0 HG2 GLN A 33 2.899 -6.915 6.527 1.00 0.00 H new ATOM 0 HG3 GLN A 33 3.434 -5.988 5.139 1.00 0.00 H new ATOM 0 HE21 GLN A 33 1.968 -3.657 5.170 1.00 0.00 H new ATOM 0 HE22 GLN A 33 2.176 -2.809 6.706 1.00 0.00 H new ATOM 534 N THR A 34 -1.929 -7.810 6.074 1.00 0.00 N ATOM 535 CA THR A 34 -3.317 -7.887 5.532 1.00 0.00 C ATOM 536 C THR A 34 -4.295 -8.178 6.673 1.00 0.00 C ATOM 537 O THR A 34 -5.416 -7.703 6.676 1.00 0.00 O ATOM 538 CB THR A 34 -3.398 -9.009 4.493 1.00 0.00 C ATOM 539 OG1 THR A 34 -2.823 -10.191 5.032 1.00 0.00 O ATOM 540 CG2 THR A 34 -2.636 -8.596 3.233 1.00 0.00 C ATOM 0 H THR A 34 -1.709 -8.495 6.797 1.00 0.00 H new ATOM 0 HA THR A 34 -3.577 -6.938 5.063 1.00 0.00 H new ATOM 0 HB THR A 34 -4.441 -9.195 4.238 1.00 0.00 H new ATOM 0 HG1 THR A 34 -1.846 -10.116 5.016 1.00 0.00 H new ATOM 0 HG21 THR A 34 -2.694 -9.395 2.494 1.00 0.00 H new ATOM 0 HG22 THR A 34 -3.078 -7.689 2.822 1.00 0.00 H new ATOM 0 HG23 THR A 34 -1.592 -8.409 3.484 1.00 0.00 H new ATOM 548 N VAL A 35 -3.876 -8.954 7.639 1.00 0.00 N ATOM 549 CA VAL A 35 -4.774 -9.283 8.787 1.00 0.00 C ATOM 550 C VAL A 35 -4.831 -8.093 9.745 1.00 0.00 C ATOM 551 O VAL A 35 -3.815 -7.544 10.128 1.00 0.00 O ATOM 552 CB VAL A 35 -4.231 -10.508 9.525 1.00 0.00 C ATOM 553 CG1 VAL A 35 -4.313 -11.733 8.612 1.00 0.00 C ATOM 554 CG2 VAL A 35 -2.772 -10.263 9.917 1.00 0.00 C ATOM 0 H VAL A 35 -2.948 -9.375 7.683 1.00 0.00 H new ATOM 0 HA VAL A 35 -5.776 -9.499 8.415 1.00 0.00 H new ATOM 0 HB VAL A 35 -4.825 -10.683 10.422 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -3.926 -12.606 9.138 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -5.352 -11.909 8.332 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -3.720 -11.558 7.714 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -2.385 -11.136 10.443 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -2.179 -10.087 9.020 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -2.712 -9.391 10.568 1.00 0.00 H new ATOM 564 N GLY A 36 -6.016 -7.691 10.134 1.00 0.00 N ATOM 565 CA GLY A 36 -6.151 -6.536 11.070 1.00 0.00 C ATOM 566 C GLY A 36 -6.484 -5.271 10.277 1.00 0.00 C ATOM 567 O GLY A 36 -7.177 -4.394 10.756 1.00 0.00 O ATOM 0 H GLY A 36 -6.897 -8.115 9.842 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -6.935 -6.736 11.801 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -5.224 -6.395 11.627 1.00 0.00 H new ATOM 571 N LYS A 37 -5.994 -5.174 9.068 1.00 0.00 N ATOM 572 CA LYS A 37 -6.275 -3.968 8.234 1.00 0.00 C ATOM 573 C LYS A 37 -7.183 -4.357 7.065 1.00 0.00 C ATOM 574 O LYS A 37 -7.386 -5.524 6.789 1.00 0.00 O ATOM 575 CB LYS A 37 -4.960 -3.403 7.693 1.00 0.00 C ATOM 576 CG LYS A 37 -4.045 -3.033 8.861 1.00 0.00 C ATOM 577 CD LYS A 37 -2.656 -2.676 8.330 1.00 0.00 C ATOM 578 CE LYS A 37 -1.673 -2.571 9.497 1.00 0.00 C ATOM 579 NZ LYS A 37 -2.103 -1.476 10.412 1.00 0.00 N ATOM 0 H LYS A 37 -5.410 -5.881 8.621 1.00 0.00 H new ATOM 0 HA LYS A 37 -6.771 -3.212 8.844 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -4.472 -4.138 7.053 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -5.155 -2.525 7.078 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -4.463 -2.190 9.411 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -3.975 -3.866 9.560 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -2.319 -3.435 7.624 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -2.695 -1.731 7.787 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -1.632 -3.516 10.038 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -0.668 -2.374 9.123 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -1.339 -1.267 11.087 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -2.317 -0.623 9.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -2.953 -1.772 10.932 1.00 0.00 H new ATOM 593 N ILE A 38 -7.730 -3.385 6.378 1.00 0.00 N ATOM 594 CA ILE A 38 -8.627 -3.687 5.225 1.00 0.00 C ATOM 595 C ILE A 38 -7.784 -3.898 3.966 1.00 0.00 C ATOM 596 O ILE A 38 -6.981 -3.060 3.599 1.00 0.00 O ATOM 597 CB ILE A 38 -9.589 -2.518 5.005 1.00 0.00 C ATOM 598 CG1 ILE A 38 -10.324 -2.211 6.313 1.00 0.00 C ATOM 599 CG2 ILE A 38 -10.607 -2.887 3.926 1.00 0.00 C ATOM 600 CD1 ILE A 38 -11.101 -0.902 6.167 1.00 0.00 C ATOM 0 H ILE A 38 -7.592 -2.392 6.568 1.00 0.00 H new ATOM 0 HA ILE A 38 -9.198 -4.591 5.436 1.00 0.00 H new ATOM 0 HB ILE A 38 -9.026 -1.641 4.687 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -11.006 -3.025 6.559 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -9.611 -2.133 7.134 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -11.291 -2.053 3.771 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -10.086 -3.107 2.994 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -11.171 -3.765 4.242 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -11.624 -0.684 7.098 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -10.409 -0.091 5.941 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -11.825 -0.997 5.358 1.00 0.00 H new ATOM 612 N MET A 39 -7.962 -5.013 3.303 1.00 0.00 N ATOM 613 CA MET A 39 -7.175 -5.289 2.065 1.00 0.00 C ATOM 614 C MET A 39 -7.956 -4.795 0.845 1.00 0.00 C ATOM 615 O MET A 39 -8.946 -5.383 0.452 1.00 0.00 O ATOM 616 CB MET A 39 -6.931 -6.795 1.940 1.00 0.00 C ATOM 617 CG MET A 39 -5.885 -7.054 0.855 1.00 0.00 C ATOM 618 SD MET A 39 -5.813 -8.828 0.498 1.00 0.00 S ATOM 619 CE MET A 39 -7.480 -8.988 -0.189 1.00 0.00 C ATOM 0 H MET A 39 -8.621 -5.745 3.568 1.00 0.00 H new ATOM 0 HA MET A 39 -6.218 -4.770 2.119 1.00 0.00 H new ATOM 0 HB2 MET A 39 -6.590 -7.199 2.893 1.00 0.00 H new ATOM 0 HB3 MET A 39 -7.862 -7.306 1.692 1.00 0.00 H new ATOM 0 HG2 MET A 39 -6.138 -6.500 -0.049 1.00 0.00 H new ATOM 0 HG3 MET A 39 -4.909 -6.698 1.184 1.00 0.00 H new ATOM 0 HE1 MET A 39 -8.047 -9.711 0.397 1.00 0.00 H new ATOM 0 HE2 MET A 39 -7.982 -8.021 -0.156 1.00 0.00 H new ATOM 0 HE3 MET A 39 -7.416 -9.328 -1.223 1.00 0.00 H new ATOM 629 N VAL A 40 -7.514 -3.719 0.244 1.00 0.00 N ATOM 630 CA VAL A 40 -8.224 -3.179 -0.953 1.00 0.00 C ATOM 631 C VAL A 40 -7.554 -3.706 -2.224 1.00 0.00 C ATOM 632 O VAL A 40 -6.374 -3.503 -2.442 1.00 0.00 O ATOM 633 CB VAL A 40 -8.159 -1.650 -0.938 1.00 0.00 C ATOM 634 CG1 VAL A 40 -9.013 -1.090 -2.076 1.00 0.00 C ATOM 635 CG2 VAL A 40 -8.691 -1.131 0.399 1.00 0.00 C ATOM 0 H VAL A 40 -6.690 -3.191 0.532 1.00 0.00 H new ATOM 0 HA VAL A 40 -9.266 -3.498 -0.932 1.00 0.00 H new ATOM 0 HB VAL A 40 -7.125 -1.330 -1.069 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -8.966 -0.001 -2.064 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -8.636 -1.459 -3.030 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -10.047 -1.410 -1.946 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -8.645 -0.042 0.411 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -9.725 -1.452 0.529 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -8.083 -1.529 1.212 1.00 0.00 H new ATOM 645 N VAL A 41 -8.300 -4.381 -3.061 1.00 0.00 N ATOM 646 CA VAL A 41 -7.716 -4.927 -4.322 1.00 0.00 C ATOM 647 C VAL A 41 -8.669 -4.652 -5.486 1.00 0.00 C ATOM 648 O VAL A 41 -9.832 -4.354 -5.289 1.00 0.00 O ATOM 649 CB VAL A 41 -7.508 -6.436 -4.177 1.00 0.00 C ATOM 650 CG1 VAL A 41 -6.440 -6.705 -3.115 1.00 0.00 C ATOM 651 CG2 VAL A 41 -8.823 -7.094 -3.753 1.00 0.00 C ATOM 0 H VAL A 41 -9.291 -4.578 -2.924 1.00 0.00 H new ATOM 0 HA VAL A 41 -6.757 -4.446 -4.516 1.00 0.00 H new ATOM 0 HB VAL A 41 -7.184 -6.850 -5.132 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -6.292 -7.780 -3.012 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -5.503 -6.237 -3.415 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -6.764 -6.290 -2.160 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -8.675 -8.169 -3.650 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -9.146 -6.679 -2.799 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -9.585 -6.904 -4.508 1.00 0.00 H new ATOM 661 N GLY A 42 -8.184 -4.751 -6.698 1.00 0.00 N ATOM 662 CA GLY A 42 -9.054 -4.497 -7.883 1.00 0.00 C ATOM 663 C GLY A 42 -9.717 -5.804 -8.320 1.00 0.00 C ATOM 664 O GLY A 42 -9.741 -6.773 -7.584 1.00 0.00 O ATOM 0 H GLY A 42 -7.219 -4.998 -6.917 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -9.814 -3.756 -7.637 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -8.462 -4.086 -8.701 1.00 0.00 H new ATOM 668 N ARG A 43 -10.255 -5.837 -9.512 1.00 0.00 N ATOM 669 CA ARG A 43 -10.920 -7.078 -10.007 1.00 0.00 C ATOM 670 C ARG A 43 -9.863 -8.039 -10.558 1.00 0.00 C ATOM 671 O ARG A 43 -9.949 -9.238 -10.376 1.00 0.00 O ATOM 672 CB ARG A 43 -11.910 -6.718 -11.117 1.00 0.00 C ATOM 673 CG ARG A 43 -11.193 -5.912 -12.201 1.00 0.00 C ATOM 674 CD ARG A 43 -12.221 -5.355 -13.188 1.00 0.00 C ATOM 675 NE ARG A 43 -11.517 -4.828 -14.398 1.00 0.00 N ATOM 676 CZ ARG A 43 -12.152 -4.673 -15.539 1.00 0.00 C ATOM 677 NH1 ARG A 43 -13.422 -4.976 -15.649 1.00 0.00 N ATOM 678 NH2 ARG A 43 -11.508 -4.212 -16.577 1.00 0.00 N ATOM 0 H ARG A 43 -10.262 -5.054 -10.166 1.00 0.00 H new ATOM 0 HA ARG A 43 -11.453 -7.557 -9.186 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -12.337 -7.625 -11.546 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -12.738 -6.139 -10.707 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -10.628 -5.097 -11.749 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -10.476 -6.544 -12.725 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -12.925 -6.136 -13.475 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -12.800 -4.561 -12.717 1.00 0.00 H new ATOM 0 HE ARG A 43 -10.528 -4.585 -14.337 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -13.932 -5.338 -14.843 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -13.901 -4.850 -16.541 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -10.519 -3.975 -16.500 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -11.994 -4.089 -17.465 1.00 0.00 H new ATOM 692 N ARG A 44 -8.867 -7.516 -11.228 1.00 0.00 N ATOM 693 CA ARG A 44 -7.798 -8.390 -11.794 1.00 0.00 C ATOM 694 C ARG A 44 -6.992 -9.014 -10.653 1.00 0.00 C ATOM 695 O ARG A 44 -6.521 -10.131 -10.754 1.00 0.00 O ATOM 696 CB ARG A 44 -6.870 -7.554 -12.678 1.00 0.00 C ATOM 697 CG ARG A 44 -6.351 -6.354 -11.883 1.00 0.00 C ATOM 698 CD ARG A 44 -5.383 -5.547 -12.751 1.00 0.00 C ATOM 699 NE ARG A 44 -6.146 -4.849 -13.833 1.00 0.00 N ATOM 700 CZ ARG A 44 -6.324 -5.414 -15.007 1.00 0.00 C ATOM 701 NH1 ARG A 44 -5.839 -6.604 -15.264 1.00 0.00 N ATOM 702 NH2 ARG A 44 -6.994 -4.779 -15.930 1.00 0.00 N ATOM 0 H ARG A 44 -8.749 -6.519 -11.407 1.00 0.00 H new ATOM 0 HA ARG A 44 -8.253 -9.180 -12.391 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -6.035 -8.163 -13.024 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -7.405 -7.213 -13.564 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -7.184 -5.725 -11.568 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -5.848 -6.694 -10.978 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -4.850 -4.819 -12.139 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -4.633 -6.207 -13.188 1.00 0.00 H new ATOM 0 HE ARG A 44 -6.533 -3.922 -13.657 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -5.314 -7.106 -14.548 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -5.986 -7.028 -16.180 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -7.374 -3.852 -15.738 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -7.137 -5.209 -16.844 1.00 0.00 H new ATOM 716 N THR A 45 -6.832 -8.298 -9.569 1.00 0.00 N ATOM 717 CA THR A 45 -6.057 -8.841 -8.414 1.00 0.00 C ATOM 718 C THR A 45 -6.939 -9.801 -7.615 1.00 0.00 C ATOM 719 O THR A 45 -6.453 -10.712 -6.972 1.00 0.00 O ATOM 720 CB THR A 45 -5.611 -7.686 -7.513 1.00 0.00 C ATOM 721 OG1 THR A 45 -5.098 -6.632 -8.315 1.00 0.00 O ATOM 722 CG2 THR A 45 -4.525 -8.176 -6.554 1.00 0.00 C ATOM 0 H THR A 45 -7.206 -7.359 -9.434 1.00 0.00 H new ATOM 0 HA THR A 45 -5.181 -9.375 -8.782 1.00 0.00 H new ATOM 0 HB THR A 45 -6.463 -7.323 -6.938 1.00 0.00 H new ATOM 0 HG1 THR A 45 -4.309 -6.245 -7.881 1.00 0.00 H new ATOM 0 HG21 THR A 45 -4.208 -7.354 -5.913 1.00 0.00 H new ATOM 0 HG22 THR A 45 -4.921 -8.984 -5.939 1.00 0.00 H new ATOM 0 HG23 THR A 45 -3.672 -8.540 -7.126 1.00 0.00 H new ATOM 730 N TYR A 46 -8.232 -9.600 -7.651 1.00 0.00 N ATOM 731 CA TYR A 46 -9.156 -10.496 -6.895 1.00 0.00 C ATOM 732 C TYR A 46 -9.098 -11.906 -7.486 1.00 0.00 C ATOM 733 O TYR A 46 -8.783 -12.862 -6.802 1.00 0.00 O ATOM 734 CB TYR A 46 -10.585 -9.957 -7.000 1.00 0.00 C ATOM 735 CG TYR A 46 -11.426 -10.541 -5.890 1.00 0.00 C ATOM 736 CD1 TYR A 46 -11.177 -10.180 -4.560 1.00 0.00 C ATOM 737 CD2 TYR A 46 -12.455 -11.441 -6.191 1.00 0.00 C ATOM 738 CE1 TYR A 46 -11.957 -10.721 -3.531 1.00 0.00 C ATOM 739 CE2 TYR A 46 -13.235 -11.982 -5.161 1.00 0.00 C ATOM 740 CZ TYR A 46 -12.986 -11.622 -3.831 1.00 0.00 C ATOM 741 OH TYR A 46 -13.755 -12.155 -2.816 1.00 0.00 O ATOM 0 H TYR A 46 -8.688 -8.852 -8.173 1.00 0.00 H new ATOM 0 HA TYR A 46 -8.855 -10.529 -5.848 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -10.581 -8.869 -6.933 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -11.012 -10.215 -7.969 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -10.384 -9.485 -4.328 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -12.647 -11.718 -7.217 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -11.765 -10.443 -2.505 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -14.029 -12.677 -5.393 1.00 0.00 H new ATOM 0 HH TYR A 46 -14.425 -12.761 -3.197 1.00 0.00 H new ATOM 751 N GLU A 47 -9.400 -12.040 -8.753 1.00 0.00 N ATOM 752 CA GLU A 47 -9.365 -13.385 -9.399 1.00 0.00 C ATOM 753 C GLU A 47 -7.928 -13.909 -9.410 1.00 0.00 C ATOM 754 O GLU A 47 -7.695 -15.103 -9.423 1.00 0.00 O ATOM 755 CB GLU A 47 -9.878 -13.274 -10.836 1.00 0.00 C ATOM 756 CG GLU A 47 -11.369 -12.933 -10.822 1.00 0.00 C ATOM 757 CD GLU A 47 -11.921 -12.999 -12.247 1.00 0.00 C ATOM 758 OE1 GLU A 47 -11.549 -12.155 -13.045 1.00 0.00 O ATOM 759 OE2 GLU A 47 -12.707 -13.893 -12.517 1.00 0.00 O ATOM 0 H GLU A 47 -9.670 -11.273 -9.368 1.00 0.00 H new ATOM 0 HA GLU A 47 -9.998 -14.073 -8.839 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -9.323 -12.504 -11.373 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -9.714 -14.213 -11.365 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -11.906 -13.631 -10.180 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -11.521 -11.936 -10.408 1.00 0.00 H new ATOM 766 N SER A 48 -6.964 -13.023 -9.405 1.00 0.00 N ATOM 767 CA SER A 48 -5.537 -13.460 -9.414 1.00 0.00 C ATOM 768 C SER A 48 -5.233 -14.255 -8.142 1.00 0.00 C ATOM 769 O SER A 48 -4.296 -15.029 -8.094 1.00 0.00 O ATOM 770 CB SER A 48 -4.629 -12.231 -9.475 1.00 0.00 C ATOM 771 OG SER A 48 -3.270 -12.650 -9.471 1.00 0.00 O ATOM 0 H SER A 48 -7.106 -12.013 -9.395 1.00 0.00 H new ATOM 0 HA SER A 48 -5.358 -14.090 -10.285 1.00 0.00 H new ATOM 0 HB2 SER A 48 -4.841 -11.653 -10.374 1.00 0.00 H new ATOM 0 HB3 SER A 48 -4.823 -11.579 -8.624 1.00 0.00 H new ATOM 0 HG SER A 48 -2.722 -11.988 -9.943 1.00 0.00 H new ATOM 777 N PHE A 49 -6.020 -14.067 -7.111 1.00 0.00 N ATOM 778 CA PHE A 49 -5.784 -14.808 -5.837 1.00 0.00 C ATOM 779 C PHE A 49 -5.946 -16.316 -6.083 1.00 0.00 C ATOM 780 O PHE A 49 -6.543 -16.714 -7.062 1.00 0.00 O ATOM 781 CB PHE A 49 -6.799 -14.351 -4.786 1.00 0.00 C ATOM 782 CG PHE A 49 -6.413 -12.983 -4.274 1.00 0.00 C ATOM 783 CD1 PHE A 49 -5.135 -12.768 -3.745 1.00 0.00 C ATOM 784 CD2 PHE A 49 -7.334 -11.930 -4.327 1.00 0.00 C ATOM 785 CE1 PHE A 49 -4.777 -11.501 -3.270 1.00 0.00 C ATOM 786 CE2 PHE A 49 -6.977 -10.663 -3.852 1.00 0.00 C ATOM 787 CZ PHE A 49 -5.698 -10.448 -3.323 1.00 0.00 C ATOM 0 H PHE A 49 -6.817 -13.430 -7.099 1.00 0.00 H new ATOM 0 HA PHE A 49 -4.774 -14.605 -5.480 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -7.799 -14.320 -5.220 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -6.831 -15.064 -3.962 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -4.425 -13.580 -3.703 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -8.320 -12.096 -4.735 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -3.790 -11.336 -2.863 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -7.688 -9.851 -3.893 1.00 0.00 H new ATOM 0 HZ PHE A 49 -5.422 -9.470 -2.956 1.00 0.00 H new ATOM 797 N PRO A 50 -5.407 -17.117 -5.187 1.00 0.00 N ATOM 798 CA PRO A 50 -5.446 -18.619 -5.235 1.00 0.00 C ATOM 799 C PRO A 50 -6.800 -19.122 -4.725 1.00 0.00 C ATOM 800 O PRO A 50 -7.622 -19.596 -5.487 1.00 0.00 O ATOM 801 CB PRO A 50 -4.320 -19.112 -4.327 1.00 0.00 C ATOM 802 CG PRO A 50 -3.838 -17.928 -3.514 1.00 0.00 C ATOM 803 CD PRO A 50 -4.651 -16.712 -3.947 1.00 0.00 C ATOM 0 HA PRO A 50 -5.317 -18.988 -6.252 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -4.676 -19.907 -3.672 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -3.505 -19.528 -4.919 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -3.968 -18.116 -2.448 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -2.774 -17.757 -3.680 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -5.337 -16.404 -3.158 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -3.999 -15.863 -4.151 1.00 0.00 H new ATOM 811 N LYS A 51 -7.034 -19.022 -3.441 1.00 0.00 N ATOM 812 CA LYS A 51 -8.331 -19.491 -2.872 1.00 0.00 C ATOM 813 C LYS A 51 -9.095 -18.298 -2.288 1.00 0.00 C ATOM 814 O LYS A 51 -9.154 -18.113 -1.086 1.00 0.00 O ATOM 815 CB LYS A 51 -8.065 -20.524 -1.771 1.00 0.00 C ATOM 816 CG LYS A 51 -7.060 -19.956 -0.760 1.00 0.00 C ATOM 817 CD LYS A 51 -7.447 -20.399 0.652 1.00 0.00 C ATOM 818 CE LYS A 51 -6.304 -20.080 1.619 1.00 0.00 C ATOM 819 NZ LYS A 51 -6.391 -18.651 2.034 1.00 0.00 N ATOM 0 H LYS A 51 -6.380 -18.634 -2.761 1.00 0.00 H new ATOM 0 HA LYS A 51 -8.928 -19.951 -3.660 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -8.997 -20.781 -1.267 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -7.675 -21.443 -2.208 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -6.054 -20.302 -0.998 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -7.045 -18.868 -0.819 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -8.357 -19.889 0.968 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -7.660 -21.468 0.664 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -6.361 -20.728 2.493 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -5.344 -20.274 1.141 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -5.615 -18.432 2.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -6.317 -18.041 1.195 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -7.302 -18.481 2.506 1.00 0.00 H new ATOM 833 N ARG A 52 -9.678 -17.489 -3.135 1.00 0.00 N ATOM 834 CA ARG A 52 -10.441 -16.304 -2.642 1.00 0.00 C ATOM 835 C ARG A 52 -11.819 -16.755 -2.136 1.00 0.00 C ATOM 836 O ARG A 52 -12.310 -17.789 -2.543 1.00 0.00 O ATOM 837 CB ARG A 52 -10.621 -15.303 -3.786 1.00 0.00 C ATOM 838 CG ARG A 52 -11.259 -16.007 -4.986 1.00 0.00 C ATOM 839 CD ARG A 52 -11.718 -14.962 -6.005 1.00 0.00 C ATOM 840 NE ARG A 52 -12.034 -15.635 -7.304 1.00 0.00 N ATOM 841 CZ ARG A 52 -13.124 -16.357 -7.445 1.00 0.00 C ATOM 842 NH1 ARG A 52 -13.967 -16.507 -6.453 1.00 0.00 N ATOM 843 NH2 ARG A 52 -13.371 -16.932 -8.590 1.00 0.00 N ATOM 0 H ARG A 52 -9.658 -17.599 -4.149 1.00 0.00 H new ATOM 0 HA ARG A 52 -9.892 -15.832 -1.827 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -11.249 -14.473 -3.462 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -9.657 -14.881 -4.069 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -10.542 -16.688 -5.445 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -12.107 -16.609 -4.659 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -12.597 -14.437 -5.632 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -10.938 -14.214 -6.151 1.00 0.00 H new ATOM 0 HE ARG A 52 -11.394 -15.532 -8.092 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -13.782 -16.060 -5.555 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -14.808 -17.070 -6.579 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -12.721 -16.820 -9.368 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -14.214 -17.494 -8.707 1.00 0.00 H new ATOM 857 N PRO A 53 -12.408 -15.968 -1.260 1.00 0.00 N ATOM 858 CA PRO A 53 -11.874 -14.672 -0.703 1.00 0.00 C ATOM 859 C PRO A 53 -10.861 -14.958 0.409 1.00 0.00 C ATOM 860 O PRO A 53 -10.758 -16.068 0.896 1.00 0.00 O ATOM 861 CB PRO A 53 -13.075 -13.913 -0.145 1.00 0.00 C ATOM 862 CG PRO A 53 -14.241 -14.880 -0.095 1.00 0.00 C ATOM 863 CD PRO A 53 -13.753 -16.219 -0.641 1.00 0.00 C ATOM 0 HA PRO A 53 -11.365 -14.089 -1.471 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -12.855 -13.525 0.850 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -13.314 -13.056 -0.775 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -14.602 -14.992 0.927 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -15.075 -14.505 -0.688 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -13.680 -16.959 0.156 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -14.451 -16.614 -1.379 1.00 0.00 H new ATOM 871 N LEU A 54 -10.114 -13.961 0.813 1.00 0.00 N ATOM 872 CA LEU A 54 -9.104 -14.162 1.892 1.00 0.00 C ATOM 873 C LEU A 54 -9.757 -13.885 3.259 1.00 0.00 C ATOM 874 O LEU A 54 -10.195 -12.780 3.505 1.00 0.00 O ATOM 875 CB LEU A 54 -7.942 -13.189 1.682 1.00 0.00 C ATOM 876 CG LEU A 54 -7.342 -13.403 0.293 1.00 0.00 C ATOM 877 CD1 LEU A 54 -6.355 -12.275 -0.018 1.00 0.00 C ATOM 878 CD2 LEU A 54 -6.607 -14.745 0.257 1.00 0.00 C ATOM 0 H LEU A 54 -10.162 -13.013 0.439 1.00 0.00 H new ATOM 0 HA LEU A 54 -8.735 -15.187 1.863 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -8.291 -12.162 1.784 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -7.181 -13.345 2.446 1.00 0.00 H new ATOM 0 HG LEU A 54 -8.140 -13.403 -0.450 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -5.928 -12.428 -1.009 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -6.876 -11.318 0.008 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -5.557 -12.274 0.725 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -6.179 -14.899 -0.733 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -5.810 -14.744 1.001 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -7.308 -15.550 0.478 1.00 0.00 H new ATOM 890 N PRO A 55 -9.810 -14.887 4.119 1.00 0.00 N ATOM 891 CA PRO A 55 -10.407 -14.804 5.496 1.00 0.00 C ATOM 892 C PRO A 55 -9.424 -14.122 6.452 1.00 0.00 C ATOM 893 O PRO A 55 -8.300 -13.830 6.093 1.00 0.00 O ATOM 894 CB PRO A 55 -10.678 -16.239 5.944 1.00 0.00 C ATOM 895 CG PRO A 55 -9.981 -17.163 4.967 1.00 0.00 C ATOM 896 CD PRO A 55 -9.299 -16.291 3.918 1.00 0.00 C ATOM 0 HA PRO A 55 -11.326 -14.218 5.494 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -10.306 -16.401 6.956 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -11.749 -16.439 5.962 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -9.250 -17.785 5.483 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -10.698 -17.837 4.498 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -8.215 -16.328 4.030 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -9.528 -16.645 2.913 1.00 0.00 H new ATOM 904 N GLU A 56 -9.844 -13.871 7.667 1.00 0.00 N ATOM 905 CA GLU A 56 -8.946 -13.207 8.662 1.00 0.00 C ATOM 906 C GLU A 56 -8.554 -11.816 8.154 1.00 0.00 C ATOM 907 O GLU A 56 -7.511 -11.293 8.499 1.00 0.00 O ATOM 908 CB GLU A 56 -7.683 -14.051 8.870 1.00 0.00 C ATOM 909 CG GLU A 56 -8.079 -15.488 9.210 1.00 0.00 C ATOM 910 CD GLU A 56 -8.626 -15.543 10.638 1.00 0.00 C ATOM 911 OE1 GLU A 56 -9.765 -15.151 10.831 1.00 0.00 O ATOM 912 OE2 GLU A 56 -7.898 -15.978 11.515 1.00 0.00 O ATOM 0 H GLU A 56 -10.776 -14.099 8.014 1.00 0.00 H new ATOM 0 HA GLU A 56 -9.474 -13.112 9.611 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -7.070 -14.035 7.969 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -7.079 -13.629 9.674 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -8.832 -15.845 8.507 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -7.216 -16.147 9.114 1.00 0.00 H new ATOM 919 N ARG A 57 -9.387 -11.214 7.342 1.00 0.00 N ATOM 920 CA ARG A 57 -9.076 -9.855 6.811 1.00 0.00 C ATOM 921 C ARG A 57 -10.240 -9.366 5.945 1.00 0.00 C ATOM 922 O ARG A 57 -10.994 -10.154 5.405 1.00 0.00 O ATOM 923 CB ARG A 57 -7.796 -9.910 5.968 1.00 0.00 C ATOM 924 CG ARG A 57 -7.957 -10.946 4.852 1.00 0.00 C ATOM 925 CD ARG A 57 -6.576 -11.427 4.400 1.00 0.00 C ATOM 926 NE ARG A 57 -6.181 -12.630 5.198 1.00 0.00 N ATOM 927 CZ ARG A 57 -5.176 -13.392 4.821 1.00 0.00 C ATOM 928 NH1 ARG A 57 -4.492 -13.118 3.738 1.00 0.00 N ATOM 929 NH2 ARG A 57 -4.855 -14.433 5.538 1.00 0.00 N ATOM 0 H ARG A 57 -10.272 -11.609 7.024 1.00 0.00 H new ATOM 0 HA ARG A 57 -8.929 -9.167 7.644 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -7.589 -8.929 5.540 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -6.945 -10.169 6.598 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -8.550 -11.789 5.207 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -8.495 -10.509 4.011 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -6.594 -11.672 3.338 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -5.841 -10.633 4.532 1.00 0.00 H new ATOM 0 HE ARG A 57 -6.698 -12.863 6.046 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -4.735 -12.304 3.173 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -3.716 -13.718 3.459 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -5.381 -14.652 6.384 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -4.078 -15.029 5.253 1.00 0.00 H new ATOM 943 N THR A 58 -10.391 -8.073 5.813 1.00 0.00 N ATOM 944 CA THR A 58 -11.505 -7.524 4.985 1.00 0.00 C ATOM 945 C THR A 58 -11.159 -7.670 3.502 1.00 0.00 C ATOM 946 O THR A 58 -10.014 -7.548 3.109 1.00 0.00 O ATOM 947 CB THR A 58 -11.707 -6.043 5.318 1.00 0.00 C ATOM 948 OG1 THR A 58 -11.715 -5.874 6.728 1.00 0.00 O ATOM 949 CG2 THR A 58 -13.038 -5.565 4.736 1.00 0.00 C ATOM 0 H THR A 58 -9.788 -7.372 6.245 1.00 0.00 H new ATOM 0 HA THR A 58 -12.422 -8.073 5.200 1.00 0.00 H new ATOM 0 HB THR A 58 -10.894 -5.458 4.887 1.00 0.00 H new ATOM 0 HG1 THR A 58 -12.572 -5.489 7.006 1.00 0.00 H new ATOM 0 HG21 THR A 58 -13.181 -4.511 4.973 1.00 0.00 H new ATOM 0 HG22 THR A 58 -13.030 -5.695 3.654 1.00 0.00 H new ATOM 0 HG23 THR A 58 -13.853 -6.148 5.165 1.00 0.00 H new ATOM 957 N ASN A 59 -12.142 -7.930 2.679 1.00 0.00 N ATOM 958 CA ASN A 59 -11.883 -8.086 1.217 1.00 0.00 C ATOM 959 C ASN A 59 -12.693 -7.044 0.441 1.00 0.00 C ATOM 960 O ASN A 59 -13.860 -7.238 0.162 1.00 0.00 O ATOM 961 CB ASN A 59 -12.302 -9.489 0.771 1.00 0.00 C ATOM 962 CG ASN A 59 -11.541 -10.534 1.590 1.00 0.00 C ATOM 963 OD1 ASN A 59 -12.129 -11.466 2.103 1.00 0.00 O ATOM 964 ND2 ASN A 59 -10.250 -10.419 1.735 1.00 0.00 N ATOM 0 H ASN A 59 -13.117 -8.041 2.958 1.00 0.00 H new ATOM 0 HA ASN A 59 -10.821 -7.943 1.020 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -13.376 -9.619 0.904 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -12.094 -9.622 -0.291 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -9.734 -11.111 2.279 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -9.756 -9.637 1.305 1.00 0.00 H new ATOM 971 N VAL A 60 -12.078 -5.942 0.093 1.00 0.00 N ATOM 972 CA VAL A 60 -12.803 -4.881 -0.665 1.00 0.00 C ATOM 973 C VAL A 60 -12.444 -4.978 -2.149 1.00 0.00 C ATOM 974 O VAL A 60 -11.367 -5.419 -2.507 1.00 0.00 O ATOM 975 CB VAL A 60 -12.401 -3.504 -0.131 1.00 0.00 C ATOM 976 CG1 VAL A 60 -13.253 -2.426 -0.801 1.00 0.00 C ATOM 977 CG2 VAL A 60 -12.623 -3.461 1.382 1.00 0.00 C ATOM 0 H VAL A 60 -11.102 -5.732 0.303 1.00 0.00 H new ATOM 0 HA VAL A 60 -13.877 -5.018 -0.541 1.00 0.00 H new ATOM 0 HB VAL A 60 -11.349 -3.323 -0.351 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -12.966 -1.446 -0.420 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -13.096 -2.456 -1.879 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -14.306 -2.606 -0.582 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -12.337 -2.481 1.764 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -13.675 -3.643 1.601 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -12.015 -4.228 1.861 1.00 0.00 H new ATOM 987 N VAL A 61 -13.338 -4.569 -3.012 1.00 0.00 N ATOM 988 CA VAL A 61 -13.059 -4.633 -4.477 1.00 0.00 C ATOM 989 C VAL A 61 -13.549 -3.347 -5.146 1.00 0.00 C ATOM 990 O VAL A 61 -14.719 -3.018 -5.094 1.00 0.00 O ATOM 991 CB VAL A 61 -13.788 -5.834 -5.083 1.00 0.00 C ATOM 992 CG1 VAL A 61 -13.384 -5.991 -6.550 1.00 0.00 C ATOM 993 CG2 VAL A 61 -13.408 -7.101 -4.314 1.00 0.00 C ATOM 0 H VAL A 61 -14.253 -4.192 -2.763 1.00 0.00 H new ATOM 0 HA VAL A 61 -11.986 -4.740 -4.639 1.00 0.00 H new ATOM 0 HB VAL A 61 -14.864 -5.675 -5.017 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -13.904 -6.847 -6.981 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -13.652 -5.089 -7.100 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -12.308 -6.149 -6.616 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -13.927 -7.957 -4.745 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -12.331 -7.258 -4.380 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -13.695 -6.992 -3.268 1.00 0.00 H new ATOM 1003 N LEU A 62 -12.660 -2.621 -5.774 1.00 0.00 N ATOM 1004 CA LEU A 62 -13.063 -1.352 -6.450 1.00 0.00 C ATOM 1005 C LEU A 62 -13.304 -1.621 -7.938 1.00 0.00 C ATOM 1006 O LEU A 62 -12.404 -2.008 -8.661 1.00 0.00 O ATOM 1007 CB LEU A 62 -11.949 -0.315 -6.294 1.00 0.00 C ATOM 1008 CG LEU A 62 -12.472 1.062 -6.705 1.00 0.00 C ATOM 1009 CD1 LEU A 62 -13.422 1.591 -5.629 1.00 0.00 C ATOM 1010 CD2 LEU A 62 -11.294 2.026 -6.863 1.00 0.00 C ATOM 0 H LEU A 62 -11.670 -2.853 -5.848 1.00 0.00 H new ATOM 0 HA LEU A 62 -13.979 -0.973 -5.996 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -11.603 -0.291 -5.261 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -11.093 -0.590 -6.911 1.00 0.00 H new ATOM 0 HG LEU A 62 -13.007 0.980 -7.651 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -13.794 2.572 -5.923 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -14.261 0.904 -5.515 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -12.889 1.674 -4.682 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -11.665 3.008 -7.156 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -10.761 2.107 -5.916 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -10.617 1.650 -7.630 1.00 0.00 H new ATOM 1022 N THR A 63 -14.513 -1.416 -8.398 1.00 0.00 N ATOM 1023 CA THR A 63 -14.823 -1.655 -9.837 1.00 0.00 C ATOM 1024 C THR A 63 -15.958 -0.727 -10.274 1.00 0.00 C ATOM 1025 O THR A 63 -16.868 -0.448 -9.517 1.00 0.00 O ATOM 1026 CB THR A 63 -15.250 -3.112 -10.032 1.00 0.00 C ATOM 1027 OG1 THR A 63 -15.679 -3.302 -11.374 1.00 0.00 O ATOM 1028 CG2 THR A 63 -16.398 -3.442 -9.076 1.00 0.00 C ATOM 0 H THR A 63 -15.300 -1.092 -7.835 1.00 0.00 H new ATOM 0 HA THR A 63 -13.937 -1.453 -10.439 1.00 0.00 H new ATOM 0 HB THR A 63 -14.406 -3.770 -9.823 1.00 0.00 H new ATOM 0 HG1 THR A 63 -15.951 -4.235 -11.501 1.00 0.00 H new ATOM 0 HG21 THR A 63 -16.701 -4.480 -9.216 1.00 0.00 H new ATOM 0 HG22 THR A 63 -16.068 -3.296 -8.047 1.00 0.00 H new ATOM 0 HG23 THR A 63 -17.244 -2.786 -9.283 1.00 0.00 H new ATOM 1036 N HIS A 64 -15.909 -0.250 -11.492 1.00 0.00 N ATOM 1037 CA HIS A 64 -16.981 0.661 -11.989 1.00 0.00 C ATOM 1038 C HIS A 64 -17.925 -0.114 -12.911 1.00 0.00 C ATOM 1039 O HIS A 64 -18.490 0.435 -13.838 1.00 0.00 O ATOM 1040 CB HIS A 64 -16.350 1.823 -12.763 1.00 0.00 C ATOM 1041 CG HIS A 64 -15.446 1.285 -13.838 1.00 0.00 C ATOM 1042 ND1 HIS A 64 -14.069 1.438 -13.789 1.00 0.00 N ATOM 1043 CD2 HIS A 64 -15.706 0.593 -14.995 1.00 0.00 C ATOM 1044 CE1 HIS A 64 -13.557 0.850 -14.888 1.00 0.00 C ATOM 1045 NE2 HIS A 64 -14.511 0.320 -15.656 1.00 0.00 N ATOM 0 H HIS A 64 -15.170 -0.454 -12.165 1.00 0.00 H new ATOM 0 HA HIS A 64 -17.543 1.053 -11.141 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -17.129 2.443 -13.206 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -15.784 2.460 -12.084 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -16.688 0.304 -15.340 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -12.503 0.812 -15.119 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -14.391 -0.178 -16.538 1.00 0.00 H new ATOM 1053 N GLN A 65 -18.096 -1.387 -12.660 1.00 0.00 N ATOM 1054 CA GLN A 65 -19.001 -2.210 -13.516 1.00 0.00 C ATOM 1055 C GLN A 65 -20.062 -2.880 -12.640 1.00 0.00 C ATOM 1056 O GLN A 65 -19.754 -3.462 -11.617 1.00 0.00 O ATOM 1057 CB GLN A 65 -18.184 -3.283 -14.239 1.00 0.00 C ATOM 1058 CG GLN A 65 -17.236 -2.616 -15.237 1.00 0.00 C ATOM 1059 CD GLN A 65 -17.984 -2.330 -16.541 1.00 0.00 C ATOM 1060 OE1 GLN A 65 -19.080 -1.807 -16.523 1.00 0.00 O ATOM 1061 NE2 GLN A 65 -17.434 -2.656 -17.679 1.00 0.00 N ATOM 0 H GLN A 65 -17.646 -1.893 -11.897 1.00 0.00 H new ATOM 0 HA GLN A 65 -19.488 -1.569 -14.250 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -17.615 -3.870 -13.518 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -18.849 -3.973 -14.758 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -16.845 -1.688 -14.819 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -16.381 -3.264 -15.431 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -16.514 -3.095 -17.693 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -17.925 -2.472 -18.554 1.00 0.00 H new ATOM 1070 N GLU A 66 -21.306 -2.801 -13.036 1.00 0.00 N ATOM 1071 CA GLU A 66 -22.395 -3.431 -12.234 1.00 0.00 C ATOM 1072 C GLU A 66 -22.561 -4.892 -12.657 1.00 0.00 C ATOM 1073 O GLU A 66 -23.644 -5.445 -12.595 1.00 0.00 O ATOM 1074 CB GLU A 66 -23.706 -2.678 -12.473 1.00 0.00 C ATOM 1075 CG GLU A 66 -23.707 -1.383 -11.658 1.00 0.00 C ATOM 1076 CD GLU A 66 -24.863 -0.493 -12.116 1.00 0.00 C ATOM 1077 OE1 GLU A 66 -25.066 -0.388 -13.314 1.00 0.00 O ATOM 1078 OE2 GLU A 66 -25.527 0.070 -11.261 1.00 0.00 O ATOM 0 H GLU A 66 -21.615 -2.325 -13.884 1.00 0.00 H new ATOM 0 HA GLU A 66 -22.138 -3.387 -11.176 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -23.820 -2.453 -13.533 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -24.553 -3.301 -12.186 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -23.807 -1.609 -10.596 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -22.759 -0.860 -11.785 1.00 0.00 H new ATOM 1085 N ASP A 67 -21.495 -5.518 -13.088 1.00 0.00 N ATOM 1086 CA ASP A 67 -21.579 -6.944 -13.518 1.00 0.00 C ATOM 1087 C ASP A 67 -20.697 -7.804 -12.611 1.00 0.00 C ATOM 1088 O ASP A 67 -20.983 -8.963 -12.372 1.00 0.00 O ATOM 1089 CB ASP A 67 -21.096 -7.069 -14.965 1.00 0.00 C ATOM 1090 CG ASP A 67 -21.567 -8.403 -15.547 1.00 0.00 C ATOM 1091 OD1 ASP A 67 -22.767 -8.622 -15.582 1.00 0.00 O ATOM 1092 OD2 ASP A 67 -20.720 -9.183 -15.948 1.00 0.00 O ATOM 0 H ASP A 67 -20.567 -5.100 -13.160 1.00 0.00 H new ATOM 0 HA ASP A 67 -22.612 -7.284 -13.448 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -21.483 -6.243 -15.561 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -20.008 -7.007 -15.003 1.00 0.00 H new ATOM 1097 N TYR A 68 -19.627 -7.244 -12.105 1.00 0.00 N ATOM 1098 CA TYR A 68 -18.719 -8.021 -11.212 1.00 0.00 C ATOM 1099 C TYR A 68 -19.449 -8.356 -9.910 1.00 0.00 C ATOM 1100 O TYR A 68 -20.214 -7.562 -9.396 1.00 0.00 O ATOM 1101 CB TYR A 68 -17.476 -7.187 -10.899 1.00 0.00 C ATOM 1102 CG TYR A 68 -16.367 -8.094 -10.420 1.00 0.00 C ATOM 1103 CD1 TYR A 68 -15.529 -8.724 -11.347 1.00 0.00 C ATOM 1104 CD2 TYR A 68 -16.178 -8.305 -9.049 1.00 0.00 C ATOM 1105 CE1 TYR A 68 -14.502 -9.565 -10.904 1.00 0.00 C ATOM 1106 CE2 TYR A 68 -15.151 -9.147 -8.605 1.00 0.00 C ATOM 1107 CZ TYR A 68 -14.313 -9.776 -9.533 1.00 0.00 C ATOM 1108 OH TYR A 68 -13.300 -10.606 -9.096 1.00 0.00 O ATOM 0 H TYR A 68 -19.344 -6.279 -12.274 1.00 0.00 H new ATOM 0 HA TYR A 68 -18.422 -8.944 -11.710 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -17.157 -6.643 -11.788 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -17.707 -6.443 -10.136 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -15.675 -8.561 -12.405 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -16.824 -7.818 -8.334 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -13.855 -10.051 -11.620 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -15.006 -9.311 -7.547 1.00 0.00 H new ATOM 0 HH TYR A 68 -13.084 -10.395 -8.164 1.00 0.00 H new ATOM 1118 N GLN A 69 -19.218 -9.528 -9.377 1.00 0.00 N ATOM 1119 CA GLN A 69 -19.894 -9.927 -8.106 1.00 0.00 C ATOM 1120 C GLN A 69 -18.887 -10.625 -7.190 1.00 0.00 C ATOM 1121 O GLN A 69 -18.037 -11.369 -7.641 1.00 0.00 O ATOM 1122 CB GLN A 69 -21.045 -10.883 -8.421 1.00 0.00 C ATOM 1123 CG GLN A 69 -22.179 -10.113 -9.102 1.00 0.00 C ATOM 1124 CD GLN A 69 -23.034 -9.417 -8.041 1.00 0.00 C ATOM 1125 OE1 GLN A 69 -23.296 -9.976 -6.994 1.00 0.00 O ATOM 1126 NE2 GLN A 69 -23.482 -8.214 -8.268 1.00 0.00 N ATOM 0 H GLN A 69 -18.588 -10.228 -9.769 1.00 0.00 H new ATOM 0 HA GLN A 69 -20.284 -9.040 -7.607 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -20.697 -11.687 -9.070 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -21.407 -11.348 -7.504 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -21.769 -9.377 -9.794 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -22.794 -10.795 -9.690 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -23.262 -7.745 -9.147 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -24.053 -7.742 -7.567 1.00 0.00 H new ATOM 1135 N ALA A 70 -18.978 -10.386 -5.906 1.00 0.00 N ATOM 1136 CA ALA A 70 -18.032 -11.031 -4.950 1.00 0.00 C ATOM 1137 C ALA A 70 -18.802 -11.524 -3.722 1.00 0.00 C ATOM 1138 O ALA A 70 -19.392 -10.744 -2.998 1.00 0.00 O ATOM 1139 CB ALA A 70 -16.975 -10.014 -4.514 1.00 0.00 C ATOM 0 H ALA A 70 -19.670 -9.770 -5.479 1.00 0.00 H new ATOM 0 HA ALA A 70 -17.545 -11.876 -5.437 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -16.283 -10.485 -3.815 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -16.426 -9.663 -5.388 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -17.462 -9.169 -4.028 1.00 0.00 H new ATOM 1145 N GLN A 71 -18.798 -12.811 -3.488 1.00 0.00 N ATOM 1146 CA GLN A 71 -19.527 -13.365 -2.309 1.00 0.00 C ATOM 1147 C GLN A 71 -18.639 -13.267 -1.068 1.00 0.00 C ATOM 1148 O GLN A 71 -17.544 -13.796 -1.035 1.00 0.00 O ATOM 1149 CB GLN A 71 -19.879 -14.831 -2.571 1.00 0.00 C ATOM 1150 CG GLN A 71 -20.942 -14.914 -3.667 1.00 0.00 C ATOM 1151 CD GLN A 71 -22.299 -14.502 -3.096 1.00 0.00 C ATOM 1152 OE1 GLN A 71 -22.657 -13.340 -3.127 1.00 0.00 O ATOM 1153 NE2 GLN A 71 -23.076 -15.409 -2.571 1.00 0.00 N ATOM 0 H GLN A 71 -18.320 -13.503 -4.064 1.00 0.00 H new ATOM 0 HA GLN A 71 -20.442 -12.795 -2.146 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -18.988 -15.382 -2.872 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -20.247 -15.296 -1.657 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -20.673 -14.263 -4.499 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -20.995 -15.929 -4.061 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -22.777 -16.384 -2.545 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -23.983 -15.143 -2.187 1.00 0.00 H new ATOM 1162 N GLY A 72 -19.105 -12.592 -0.047 1.00 0.00 N ATOM 1163 CA GLY A 72 -18.295 -12.453 1.199 1.00 0.00 C ATOM 1164 C GLY A 72 -17.241 -11.362 1.005 1.00 0.00 C ATOM 1165 O GLY A 72 -16.103 -11.507 1.414 1.00 0.00 O ATOM 0 H GLY A 72 -20.014 -12.130 -0.024 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -18.942 -12.203 2.040 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -17.813 -13.401 1.439 1.00 0.00 H new ATOM 1169 N ALA A 73 -17.611 -10.271 0.384 1.00 0.00 N ATOM 1170 CA ALA A 73 -16.637 -9.163 0.157 1.00 0.00 C ATOM 1171 C ALA A 73 -17.396 -7.851 -0.050 1.00 0.00 C ATOM 1172 O ALA A 73 -18.470 -7.830 -0.622 1.00 0.00 O ATOM 1173 CB ALA A 73 -15.797 -9.469 -1.084 1.00 0.00 C ATOM 0 H ALA A 73 -18.550 -10.100 0.023 1.00 0.00 H new ATOM 0 HA ALA A 73 -15.983 -9.071 1.024 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -15.086 -8.660 -1.250 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -15.256 -10.404 -0.936 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -16.450 -9.562 -1.952 1.00 0.00 H new ATOM 1179 N VAL A 74 -16.843 -6.757 0.410 1.00 0.00 N ATOM 1180 CA VAL A 74 -17.526 -5.441 0.244 1.00 0.00 C ATOM 1181 C VAL A 74 -17.222 -4.882 -1.148 1.00 0.00 C ATOM 1182 O VAL A 74 -16.190 -4.276 -1.371 1.00 0.00 O ATOM 1183 CB VAL A 74 -17.016 -4.465 1.308 1.00 0.00 C ATOM 1184 CG1 VAL A 74 -17.822 -3.166 1.237 1.00 0.00 C ATOM 1185 CG2 VAL A 74 -17.183 -5.091 2.694 1.00 0.00 C ATOM 0 H VAL A 74 -15.946 -6.720 0.894 1.00 0.00 H new ATOM 0 HA VAL A 74 -18.602 -5.572 0.356 1.00 0.00 H new ATOM 0 HB VAL A 74 -15.963 -4.250 1.129 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -17.459 -2.471 1.994 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -17.706 -2.720 0.249 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -18.875 -3.381 1.417 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -16.820 -4.397 3.453 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -18.237 -5.305 2.872 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -16.611 -6.017 2.746 1.00 0.00 H new ATOM 1195 N VAL A 75 -18.115 -5.082 -2.084 1.00 0.00 N ATOM 1196 CA VAL A 75 -17.888 -4.567 -3.466 1.00 0.00 C ATOM 1197 C VAL A 75 -18.153 -3.060 -3.498 1.00 0.00 C ATOM 1198 O VAL A 75 -19.287 -2.622 -3.557 1.00 0.00 O ATOM 1199 CB VAL A 75 -18.839 -5.272 -4.436 1.00 0.00 C ATOM 1200 CG1 VAL A 75 -18.503 -4.860 -5.871 1.00 0.00 C ATOM 1201 CG2 VAL A 75 -18.680 -6.788 -4.293 1.00 0.00 C ATOM 0 H VAL A 75 -18.994 -5.582 -1.949 1.00 0.00 H new ATOM 0 HA VAL A 75 -16.857 -4.762 -3.762 1.00 0.00 H new ATOM 0 HB VAL A 75 -19.866 -4.989 -4.207 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -19.180 -5.362 -6.562 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -18.613 -3.781 -5.975 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -17.476 -5.143 -6.100 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -19.357 -7.292 -4.983 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -17.652 -7.069 -4.522 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -18.918 -7.084 -3.271 1.00 0.00 H new ATOM 1211 N VAL A 76 -17.114 -2.266 -3.460 1.00 0.00 N ATOM 1212 CA VAL A 76 -17.293 -0.784 -3.488 1.00 0.00 C ATOM 1213 C VAL A 76 -17.258 -0.294 -4.936 1.00 0.00 C ATOM 1214 O VAL A 76 -16.662 -0.914 -5.796 1.00 0.00 O ATOM 1215 CB VAL A 76 -16.167 -0.119 -2.695 1.00 0.00 C ATOM 1216 CG1 VAL A 76 -16.293 -0.490 -1.217 1.00 0.00 C ATOM 1217 CG2 VAL A 76 -14.815 -0.600 -3.227 1.00 0.00 C ATOM 0 H VAL A 76 -16.145 -2.582 -3.411 1.00 0.00 H new ATOM 0 HA VAL A 76 -18.253 -0.525 -3.041 1.00 0.00 H new ATOM 0 HB VAL A 76 -16.238 0.963 -2.805 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -15.490 -0.015 -0.653 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -17.255 -0.147 -0.837 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -16.224 -1.572 -1.106 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -14.012 -0.126 -2.662 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -14.745 -1.682 -3.118 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -14.723 -0.335 -4.280 1.00 0.00 H new ATOM 1227 N HIS A 77 -17.895 0.817 -5.209 1.00 0.00 N ATOM 1228 CA HIS A 77 -17.906 1.359 -6.601 1.00 0.00 C ATOM 1229 C HIS A 77 -17.644 2.865 -6.563 1.00 0.00 C ATOM 1230 O HIS A 77 -18.114 3.605 -7.407 1.00 0.00 O ATOM 1231 CB HIS A 77 -19.270 1.094 -7.240 1.00 0.00 C ATOM 1232 CG HIS A 77 -19.518 -0.388 -7.298 1.00 0.00 C ATOM 1233 ND1 HIS A 77 -19.140 -1.159 -8.386 1.00 0.00 N ATOM 1234 CD2 HIS A 77 -20.105 -1.255 -6.410 1.00 0.00 C ATOM 1235 CE1 HIS A 77 -19.501 -2.430 -8.127 1.00 0.00 C ATOM 1236 NE2 HIS A 77 -20.093 -2.544 -6.936 1.00 0.00 N ATOM 0 H HIS A 77 -18.409 1.373 -4.526 1.00 0.00 H new ATOM 0 HA HIS A 77 -17.129 0.870 -7.188 1.00 0.00 H new ATOM 0 HB2 HIS A 77 -20.055 1.582 -6.662 1.00 0.00 H new ATOM 0 HB3 HIS A 77 -19.302 1.518 -8.244 1.00 0.00 H new ATOM 0 HD1 HIS A 77 -18.673 -0.825 -9.229 1.00 0.00 H new ATOM 0 HD2 HIS A 77 -20.514 -0.979 -5.449 1.00 0.00 H new ATOM 0 HE1 HIS A 77 -19.332 -3.257 -8.801 1.00 0.00 H new ATOM 1244 N ASP A 78 -16.895 3.322 -5.591 1.00 0.00 N ATOM 1245 CA ASP A 78 -16.596 4.780 -5.491 1.00 0.00 C ATOM 1246 C ASP A 78 -15.461 5.000 -4.489 1.00 0.00 C ATOM 1247 O ASP A 78 -15.319 4.264 -3.530 1.00 0.00 O ATOM 1248 CB ASP A 78 -17.845 5.526 -5.017 1.00 0.00 C ATOM 1249 CG ASP A 78 -17.698 7.017 -5.327 1.00 0.00 C ATOM 1250 OD1 ASP A 78 -17.785 7.370 -6.492 1.00 0.00 O ATOM 1251 OD2 ASP A 78 -17.502 7.779 -4.395 1.00 0.00 O ATOM 0 H ASP A 78 -16.477 2.745 -4.861 1.00 0.00 H new ATOM 0 HA ASP A 78 -16.297 5.157 -6.469 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -18.730 5.126 -5.512 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -17.985 5.379 -3.946 1.00 0.00 H new ATOM 1256 N VAL A 79 -14.655 6.007 -4.705 1.00 0.00 N ATOM 1257 CA VAL A 79 -13.524 6.284 -3.771 1.00 0.00 C ATOM 1258 C VAL A 79 -14.079 6.764 -2.428 1.00 0.00 C ATOM 1259 O VAL A 79 -13.515 6.495 -1.384 1.00 0.00 O ATOM 1260 CB VAL A 79 -12.623 7.367 -4.367 1.00 0.00 C ATOM 1261 CG1 VAL A 79 -11.384 7.543 -3.486 1.00 0.00 C ATOM 1262 CG2 VAL A 79 -12.189 6.952 -5.775 1.00 0.00 C ATOM 0 H VAL A 79 -14.732 6.652 -5.492 1.00 0.00 H new ATOM 0 HA VAL A 79 -12.945 5.373 -3.621 1.00 0.00 H new ATOM 0 HB VAL A 79 -13.172 8.308 -4.416 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -10.742 8.315 -3.911 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -11.690 7.838 -2.482 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -10.836 6.602 -3.437 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -11.547 7.724 -6.200 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -11.641 6.011 -5.724 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -13.070 6.825 -6.405 1.00 0.00 H new ATOM 1272 N ALA A 80 -15.179 7.473 -2.451 1.00 0.00 N ATOM 1273 CA ALA A 80 -15.780 7.976 -1.180 1.00 0.00 C ATOM 1274 C ALA A 80 -16.331 6.797 -0.376 1.00 0.00 C ATOM 1275 O ALA A 80 -16.319 6.808 0.841 1.00 0.00 O ATOM 1276 CB ALA A 80 -16.915 8.950 -1.503 1.00 0.00 C ATOM 0 H ALA A 80 -15.688 7.726 -3.298 1.00 0.00 H new ATOM 0 HA ALA A 80 -15.017 8.490 -0.595 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -17.354 9.317 -0.576 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -16.522 9.790 -2.076 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -17.679 8.438 -2.088 1.00 0.00 H new ATOM 1282 N ALA A 81 -16.813 5.783 -1.049 1.00 0.00 N ATOM 1283 CA ALA A 81 -17.369 4.598 -0.332 1.00 0.00 C ATOM 1284 C ALA A 81 -16.237 3.863 0.389 1.00 0.00 C ATOM 1285 O ALA A 81 -16.418 3.339 1.473 1.00 0.00 O ATOM 1286 CB ALA A 81 -18.028 3.655 -1.340 1.00 0.00 C ATOM 0 H ALA A 81 -16.845 5.726 -2.067 1.00 0.00 H new ATOM 0 HA ALA A 81 -18.111 4.928 0.395 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -18.434 2.789 -0.817 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -18.833 4.178 -1.855 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -17.287 3.324 -2.067 1.00 0.00 H new ATOM 1292 N VAL A 82 -15.073 3.821 -0.206 1.00 0.00 N ATOM 1293 CA VAL A 82 -13.921 3.122 0.436 1.00 0.00 C ATOM 1294 C VAL A 82 -13.460 3.918 1.660 1.00 0.00 C ATOM 1295 O VAL A 82 -13.123 3.355 2.685 1.00 0.00 O ATOM 1296 CB VAL A 82 -12.769 3.012 -0.565 1.00 0.00 C ATOM 1297 CG1 VAL A 82 -11.646 2.166 0.038 1.00 0.00 C ATOM 1298 CG2 VAL A 82 -13.272 2.348 -1.849 1.00 0.00 C ATOM 0 H VAL A 82 -14.871 4.243 -1.112 1.00 0.00 H new ATOM 0 HA VAL A 82 -14.229 2.123 0.746 1.00 0.00 H new ATOM 0 HB VAL A 82 -12.391 4.008 -0.793 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -10.826 2.088 -0.676 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -11.287 2.637 0.953 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -12.024 1.169 0.267 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -12.452 2.269 -2.563 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -13.650 1.352 -1.619 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -14.072 2.950 -2.280 1.00 0.00 H new ATOM 1308 N PHE A 83 -13.444 5.223 1.556 1.00 0.00 N ATOM 1309 CA PHE A 83 -13.007 6.065 2.707 1.00 0.00 C ATOM 1310 C PHE A 83 -14.130 6.136 3.744 1.00 0.00 C ATOM 1311 O PHE A 83 -13.884 6.241 4.931 1.00 0.00 O ATOM 1312 CB PHE A 83 -12.681 7.475 2.212 1.00 0.00 C ATOM 1313 CG PHE A 83 -11.322 7.478 1.555 1.00 0.00 C ATOM 1314 CD1 PHE A 83 -10.187 7.121 2.294 1.00 0.00 C ATOM 1315 CD2 PHE A 83 -11.196 7.836 0.208 1.00 0.00 C ATOM 1316 CE1 PHE A 83 -8.927 7.122 1.685 1.00 0.00 C ATOM 1317 CE2 PHE A 83 -9.935 7.838 -0.401 1.00 0.00 C ATOM 1318 CZ PHE A 83 -8.800 7.481 0.337 1.00 0.00 C ATOM 0 H PHE A 83 -13.716 5.741 0.721 1.00 0.00 H new ATOM 0 HA PHE A 83 -12.120 5.625 3.162 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -13.440 7.807 1.503 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -12.695 8.177 3.046 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -10.284 6.845 3.334 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -12.071 8.111 -0.362 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -8.052 6.846 2.255 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -9.838 8.115 -1.440 1.00 0.00 H new ATOM 0 HZ PHE A 83 -7.827 7.482 -0.133 1.00 0.00 H new ATOM 1328 N ALA A 84 -15.360 6.078 3.302 1.00 0.00 N ATOM 1329 CA ALA A 84 -16.508 6.141 4.254 1.00 0.00 C ATOM 1330 C ALA A 84 -16.522 4.880 5.121 1.00 0.00 C ATOM 1331 O ALA A 84 -16.871 4.923 6.286 1.00 0.00 O ATOM 1332 CB ALA A 84 -17.817 6.233 3.467 1.00 0.00 C ATOM 0 H ALA A 84 -15.619 5.989 2.319 1.00 0.00 H new ATOM 0 HA ALA A 84 -16.404 7.019 4.892 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -18.656 6.279 4.161 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -17.808 7.131 2.849 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -17.921 5.355 2.830 1.00 0.00 H new ATOM 1338 N TYR A 85 -16.144 3.760 4.560 1.00 0.00 N ATOM 1339 CA TYR A 85 -16.131 2.490 5.343 1.00 0.00 C ATOM 1340 C TYR A 85 -14.964 2.512 6.332 1.00 0.00 C ATOM 1341 O TYR A 85 -15.052 1.978 7.421 1.00 0.00 O ATOM 1342 CB TYR A 85 -15.967 1.305 4.390 1.00 0.00 C ATOM 1343 CG TYR A 85 -16.343 0.028 5.103 1.00 0.00 C ATOM 1344 CD1 TYR A 85 -17.681 -0.382 5.146 1.00 0.00 C ATOM 1345 CD2 TYR A 85 -15.354 -0.745 5.723 1.00 0.00 C ATOM 1346 CE1 TYR A 85 -18.030 -1.565 5.809 1.00 0.00 C ATOM 1347 CE2 TYR A 85 -15.702 -1.928 6.385 1.00 0.00 C ATOM 1348 CZ TYR A 85 -17.040 -2.338 6.428 1.00 0.00 C ATOM 1349 OH TYR A 85 -17.384 -3.504 7.080 1.00 0.00 O ATOM 0 H TYR A 85 -15.843 3.671 3.590 1.00 0.00 H new ATOM 0 HA TYR A 85 -17.069 2.391 5.889 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -16.597 1.442 3.511 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -14.937 1.248 4.038 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -18.444 0.214 4.668 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -14.322 -0.428 5.690 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -19.062 -1.881 5.843 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -14.939 -2.524 6.863 1.00 0.00 H new ATOM 0 HH TYR A 85 -16.579 -3.920 7.453 1.00 0.00 H new ATOM 1359 N ALA A 86 -13.872 3.130 5.958 1.00 0.00 N ATOM 1360 CA ALA A 86 -12.692 3.194 6.870 1.00 0.00 C ATOM 1361 C ALA A 86 -13.015 4.099 8.061 1.00 0.00 C ATOM 1362 O ALA A 86 -12.507 3.907 9.151 1.00 0.00 O ATOM 1363 CB ALA A 86 -11.491 3.762 6.111 1.00 0.00 C ATOM 0 H ALA A 86 -13.748 3.594 5.058 1.00 0.00 H new ATOM 0 HA ALA A 86 -12.456 2.192 7.228 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -10.629 3.809 6.777 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -11.259 3.118 5.262 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -11.728 4.764 5.753 1.00 0.00 H new ATOM 1369 N LYS A 87 -13.856 5.081 7.859 1.00 0.00 N ATOM 1370 CA LYS A 87 -14.219 6.005 8.973 1.00 0.00 C ATOM 1371 C LYS A 87 -15.018 5.240 10.031 1.00 0.00 C ATOM 1372 O LYS A 87 -14.804 5.400 11.218 1.00 0.00 O ATOM 1373 CB LYS A 87 -15.067 7.155 8.427 1.00 0.00 C ATOM 1374 CG LYS A 87 -14.159 8.180 7.745 1.00 0.00 C ATOM 1375 CD LYS A 87 -15.003 9.346 7.227 1.00 0.00 C ATOM 1376 CE LYS A 87 -14.087 10.515 6.857 1.00 0.00 C ATOM 1377 NZ LYS A 87 -13.493 11.092 8.096 1.00 0.00 N ATOM 0 H LYS A 87 -14.308 5.282 6.967 1.00 0.00 H new ATOM 0 HA LYS A 87 -13.310 6.405 9.423 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -15.801 6.774 7.717 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -15.623 7.628 9.237 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -13.411 8.544 8.449 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -13.621 7.713 6.921 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -15.580 9.033 6.357 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -15.718 9.657 7.988 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -13.298 10.174 6.187 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -14.652 11.278 6.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -13.755 12.096 8.172 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -13.852 10.577 8.925 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -12.457 11.006 8.057 1.00 0.00 H new ATOM 1391 N GLN A 88 -15.937 4.410 9.606 1.00 0.00 N ATOM 1392 CA GLN A 88 -16.756 3.629 10.579 1.00 0.00 C ATOM 1393 C GLN A 88 -15.858 2.639 11.324 1.00 0.00 C ATOM 1394 O GLN A 88 -16.130 2.268 12.450 1.00 0.00 O ATOM 1395 CB GLN A 88 -17.847 2.863 9.828 1.00 0.00 C ATOM 1396 CG GLN A 88 -18.937 3.836 9.377 1.00 0.00 C ATOM 1397 CD GLN A 88 -20.115 3.051 8.797 1.00 0.00 C ATOM 1398 OE1 GLN A 88 -21.253 3.289 9.151 1.00 0.00 O ATOM 1399 NE2 GLN A 88 -19.889 2.114 7.917 1.00 0.00 N ATOM 0 H GLN A 88 -16.155 4.240 8.624 1.00 0.00 H new ATOM 0 HA GLN A 88 -17.217 4.310 11.294 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -17.419 2.354 8.964 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -18.275 2.094 10.472 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -19.270 4.442 10.220 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -18.540 4.522 8.629 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -18.934 1.914 7.619 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -20.667 1.582 7.527 1.00 0.00 H new ATOM 1408 N HIS A 89 -14.789 2.211 10.701 1.00 0.00 N ATOM 1409 CA HIS A 89 -13.866 1.244 11.362 1.00 0.00 C ATOM 1410 C HIS A 89 -12.471 1.874 11.492 1.00 0.00 C ATOM 1411 O HIS A 89 -11.654 1.734 10.605 1.00 0.00 O ATOM 1412 CB HIS A 89 -13.773 -0.031 10.520 1.00 0.00 C ATOM 1413 CG HIS A 89 -15.023 -0.844 10.700 1.00 0.00 C ATOM 1414 ND1 HIS A 89 -14.991 -2.169 11.108 1.00 0.00 N ATOM 1415 CD2 HIS A 89 -16.352 -0.535 10.534 1.00 0.00 C ATOM 1416 CE1 HIS A 89 -16.263 -2.605 11.171 1.00 0.00 C ATOM 1417 NE2 HIS A 89 -17.131 -1.649 10.832 1.00 0.00 N ATOM 0 H HIS A 89 -14.516 2.492 9.759 1.00 0.00 H new ATOM 0 HA HIS A 89 -14.248 0.998 12.353 1.00 0.00 H new ATOM 0 HB2 HIS A 89 -13.641 0.224 9.469 1.00 0.00 H new ATOM 0 HB3 HIS A 89 -12.902 -0.614 10.819 1.00 0.00 H new ATOM 0 HD2 HIS A 89 -16.733 0.425 10.220 1.00 0.00 H new ATOM 0 HE1 HIS A 89 -16.547 -3.606 11.460 1.00 0.00 H new ATOM 0 HE2 HIS A 89 -18.148 -1.720 10.799 1.00 0.00 H new ATOM 1425 N PRO A 90 -12.234 2.554 12.595 1.00 0.00 N ATOM 1426 CA PRO A 90 -10.942 3.247 12.922 1.00 0.00 C ATOM 1427 C PRO A 90 -9.919 2.229 13.435 1.00 0.00 C ATOM 1428 O PRO A 90 -8.725 2.452 13.371 1.00 0.00 O ATOM 1429 CB PRO A 90 -11.261 4.275 14.006 1.00 0.00 C ATOM 1430 CG PRO A 90 -12.652 3.973 14.525 1.00 0.00 C ATOM 1431 CD PRO A 90 -13.186 2.777 13.743 1.00 0.00 C ATOM 0 HA PRO A 90 -10.515 3.729 12.042 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -10.530 4.220 14.813 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -11.214 5.286 13.601 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -12.623 3.751 15.592 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -13.305 4.837 14.397 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -13.242 1.893 14.378 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -14.194 2.972 13.378 1.00 0.00 H new ATOM 1439 N ASP A 91 -10.382 1.116 13.943 1.00 0.00 N ATOM 1440 CA ASP A 91 -9.447 0.076 14.463 1.00 0.00 C ATOM 1441 C ASP A 91 -8.670 -0.538 13.297 1.00 0.00 C ATOM 1442 O ASP A 91 -7.564 -1.019 13.463 1.00 0.00 O ATOM 1443 CB ASP A 91 -10.243 -1.017 15.178 1.00 0.00 C ATOM 1444 CG ASP A 91 -9.294 -1.879 16.012 1.00 0.00 C ATOM 1445 OD1 ASP A 91 -8.840 -1.402 17.039 1.00 0.00 O ATOM 1446 OD2 ASP A 91 -9.037 -3.002 15.610 1.00 0.00 O ATOM 0 H ASP A 91 -11.372 0.883 14.020 1.00 0.00 H new ATOM 0 HA ASP A 91 -8.750 0.533 15.165 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -11.002 -0.568 15.819 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -10.767 -1.635 14.449 1.00 0.00 H new ATOM 1451 N GLN A 92 -9.242 -0.525 12.120 1.00 0.00 N ATOM 1452 CA GLN A 92 -8.544 -1.105 10.935 1.00 0.00 C ATOM 1453 C GLN A 92 -7.869 0.015 10.143 1.00 0.00 C ATOM 1454 O GLN A 92 -7.948 1.174 10.502 1.00 0.00 O ATOM 1455 CB GLN A 92 -9.563 -1.820 10.044 1.00 0.00 C ATOM 1456 CG GLN A 92 -10.210 -2.966 10.823 1.00 0.00 C ATOM 1457 CD GLN A 92 -11.093 -3.788 9.883 1.00 0.00 C ATOM 1458 OE1 GLN A 92 -12.261 -3.994 10.153 1.00 0.00 O ATOM 1459 NE2 GLN A 92 -10.584 -4.269 8.783 1.00 0.00 N ATOM 0 H GLN A 92 -10.165 -0.136 11.929 1.00 0.00 H new ATOM 0 HA GLN A 92 -7.790 -1.818 11.269 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -10.326 -1.117 9.711 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -9.073 -2.206 9.150 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -9.441 -3.600 11.264 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -10.806 -2.570 11.645 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -9.605 -4.096 8.556 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -11.165 -4.818 8.149 1.00 0.00 H new ATOM 1468 N GLU A 93 -7.206 -0.325 9.066 1.00 0.00 N ATOM 1469 CA GLU A 93 -6.521 0.713 8.243 1.00 0.00 C ATOM 1470 C GLU A 93 -6.716 0.398 6.759 1.00 0.00 C ATOM 1471 O GLU A 93 -7.120 -0.691 6.395 1.00 0.00 O ATOM 1472 CB GLU A 93 -5.026 0.720 8.570 1.00 0.00 C ATOM 1473 CG GLU A 93 -4.797 1.446 9.897 1.00 0.00 C ATOM 1474 CD GLU A 93 -5.009 2.948 9.702 1.00 0.00 C ATOM 1475 OE1 GLU A 93 -4.463 3.484 8.751 1.00 0.00 O ATOM 1476 OE2 GLU A 93 -5.712 3.537 10.506 1.00 0.00 O ATOM 0 H GLU A 93 -7.111 -1.280 8.722 1.00 0.00 H new ATOM 0 HA GLU A 93 -6.946 1.691 8.466 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -4.652 -0.302 8.633 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -4.471 1.214 7.773 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -5.483 1.067 10.654 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -3.787 1.255 10.258 1.00 0.00 H new ATOM 1483 N LEU A 94 -6.433 1.346 5.900 1.00 0.00 N ATOM 1484 CA LEU A 94 -6.599 1.112 4.436 1.00 0.00 C ATOM 1485 C LEU A 94 -5.254 0.713 3.827 1.00 0.00 C ATOM 1486 O LEU A 94 -4.254 1.381 4.020 1.00 0.00 O ATOM 1487 CB LEU A 94 -7.102 2.394 3.768 1.00 0.00 C ATOM 1488 CG LEU A 94 -7.700 2.058 2.401 1.00 0.00 C ATOM 1489 CD1 LEU A 94 -9.084 1.436 2.588 1.00 0.00 C ATOM 1490 CD2 LEU A 94 -7.824 3.339 1.573 1.00 0.00 C ATOM 0 H LEU A 94 -6.093 2.274 6.153 1.00 0.00 H new ATOM 0 HA LEU A 94 -7.321 0.312 4.276 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -7.852 2.874 4.397 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -6.282 3.103 3.653 1.00 0.00 H new ATOM 0 HG LEU A 94 -7.052 1.350 1.884 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -9.510 1.197 1.614 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -8.996 0.525 3.180 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -9.734 2.143 3.104 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -8.250 3.102 0.598 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -8.473 4.045 2.091 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -6.837 3.783 1.440 1.00 0.00 H new ATOM 1502 N VAL A 95 -5.222 -0.370 3.093 1.00 0.00 N ATOM 1503 CA VAL A 95 -3.945 -0.820 2.466 1.00 0.00 C ATOM 1504 C VAL A 95 -4.188 -1.147 0.992 1.00 0.00 C ATOM 1505 O VAL A 95 -5.142 -1.818 0.646 1.00 0.00 O ATOM 1506 CB VAL A 95 -3.435 -2.070 3.187 1.00 0.00 C ATOM 1507 CG1 VAL A 95 -2.052 -2.442 2.650 1.00 0.00 C ATOM 1508 CG2 VAL A 95 -3.337 -1.787 4.689 1.00 0.00 C ATOM 0 H VAL A 95 -6.029 -0.963 2.901 1.00 0.00 H new ATOM 0 HA VAL A 95 -3.203 -0.026 2.545 1.00 0.00 H new ATOM 0 HB VAL A 95 -4.126 -2.895 3.015 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -1.689 -3.332 3.164 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -2.119 -2.642 1.581 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -1.361 -1.617 2.822 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -2.974 -2.676 5.204 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -2.646 -0.962 4.859 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -4.321 -1.521 5.074 1.00 0.00 H new ATOM 1518 N ILE A 96 -3.332 -0.675 0.121 1.00 0.00 N ATOM 1519 CA ILE A 96 -3.503 -0.952 -1.335 1.00 0.00 C ATOM 1520 C ILE A 96 -2.500 -2.021 -1.771 1.00 0.00 C ATOM 1521 O ILE A 96 -1.306 -1.877 -1.584 1.00 0.00 O ATOM 1522 CB ILE A 96 -3.261 0.333 -2.131 1.00 0.00 C ATOM 1523 CG1 ILE A 96 -4.134 1.469 -1.572 1.00 0.00 C ATOM 1524 CG2 ILE A 96 -3.601 0.095 -3.606 1.00 0.00 C ATOM 1525 CD1 ILE A 96 -5.620 1.103 -1.678 1.00 0.00 C ATOM 0 H ILE A 96 -2.519 -0.107 0.359 1.00 0.00 H new ATOM 0 HA ILE A 96 -4.516 -1.308 -1.521 1.00 0.00 H new ATOM 0 HB ILE A 96 -2.212 0.616 -2.043 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -3.873 1.658 -0.531 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -3.940 2.390 -2.122 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -3.428 1.011 -4.172 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -2.969 -0.700 -4.001 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -4.648 -0.195 -3.696 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -6.225 1.917 -1.278 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -5.880 0.937 -2.723 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -5.812 0.194 -1.108 1.00 0.00 H new ATOM 1537 N ALA A 97 -2.977 -3.093 -2.352 1.00 0.00 N ATOM 1538 CA ALA A 97 -2.059 -4.178 -2.805 1.00 0.00 C ATOM 1539 C ALA A 97 -2.009 -4.199 -4.334 1.00 0.00 C ATOM 1540 O ALA A 97 -1.024 -4.601 -4.925 1.00 0.00 O ATOM 1541 CB ALA A 97 -2.572 -5.526 -2.293 1.00 0.00 C ATOM 0 H ALA A 97 -3.967 -3.262 -2.532 1.00 0.00 H new ATOM 0 HA ALA A 97 -1.059 -3.996 -2.412 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -1.902 -6.320 -2.623 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -2.608 -5.512 -1.204 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -3.572 -5.708 -2.687 1.00 0.00 H new ATOM 1547 N GLY A 98 -3.065 -3.770 -4.976 1.00 0.00 N ATOM 1548 CA GLY A 98 -3.090 -3.760 -6.468 1.00 0.00 C ATOM 1549 C GLY A 98 -4.542 -3.622 -6.957 1.00 0.00 C ATOM 1550 O GLY A 98 -5.453 -3.534 -6.158 1.00 0.00 O ATOM 0 H GLY A 98 -3.914 -3.425 -4.528 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -2.488 -2.934 -6.847 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -2.650 -4.679 -6.856 1.00 0.00 H new ATOM 1554 N GLY A 99 -4.789 -3.601 -8.256 1.00 0.00 N ATOM 1555 CA GLY A 99 -3.690 -3.707 -9.272 1.00 0.00 C ATOM 1556 C GLY A 99 -3.076 -2.326 -9.508 1.00 0.00 C ATOM 1557 O GLY A 99 -3.130 -1.461 -8.654 1.00 0.00 O ATOM 0 H GLY A 99 -5.723 -3.513 -8.655 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -2.925 -4.402 -8.925 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -4.082 -4.106 -10.207 1.00 0.00 H new ATOM 1561 N ALA A 100 -2.494 -2.116 -10.661 1.00 0.00 N ATOM 1562 CA ALA A 100 -1.873 -0.794 -10.963 1.00 0.00 C ATOM 1563 C ALA A 100 -2.963 0.278 -11.033 1.00 0.00 C ATOM 1564 O ALA A 100 -2.739 1.425 -10.692 1.00 0.00 O ATOM 1565 CB ALA A 100 -1.144 -0.867 -12.306 1.00 0.00 C ATOM 0 H ALA A 100 -2.423 -2.807 -11.408 1.00 0.00 H new ATOM 0 HA ALA A 100 -1.162 -0.539 -10.177 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -0.690 0.099 -12.527 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -0.367 -1.630 -12.257 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -1.854 -1.122 -13.092 1.00 0.00 H new ATOM 1571 N GLN A 101 -4.139 -0.090 -11.473 1.00 0.00 N ATOM 1572 CA GLN A 101 -5.252 0.900 -11.569 1.00 0.00 C ATOM 1573 C GLN A 101 -5.730 1.268 -10.163 1.00 0.00 C ATOM 1574 O GLN A 101 -6.165 2.377 -9.917 1.00 0.00 O ATOM 1575 CB GLN A 101 -6.411 0.288 -12.358 1.00 0.00 C ATOM 1576 CG GLN A 101 -7.308 1.403 -12.898 1.00 0.00 C ATOM 1577 CD GLN A 101 -8.253 0.832 -13.956 1.00 0.00 C ATOM 1578 OE1 GLN A 101 -7.988 0.924 -15.138 1.00 0.00 O ATOM 1579 NE2 GLN A 101 -9.353 0.241 -13.579 1.00 0.00 N ATOM 0 H GLN A 101 -4.376 -1.036 -11.771 1.00 0.00 H new ATOM 0 HA GLN A 101 -4.899 1.796 -12.078 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -6.026 -0.314 -13.181 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -6.988 -0.379 -11.718 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -7.882 1.848 -12.085 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -6.699 2.197 -13.330 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -9.576 0.163 -12.587 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -9.990 -0.144 -14.276 1.00 0.00 H new ATOM 1588 N ILE A 102 -5.652 0.342 -9.240 1.00 0.00 N ATOM 1589 CA ILE A 102 -6.100 0.627 -7.846 1.00 0.00 C ATOM 1590 C ILE A 102 -5.085 1.545 -7.161 1.00 0.00 C ATOM 1591 O ILE A 102 -5.444 2.404 -6.376 1.00 0.00 O ATOM 1592 CB ILE A 102 -6.209 -0.686 -7.065 1.00 0.00 C ATOM 1593 CG1 ILE A 102 -7.095 -1.679 -7.836 1.00 0.00 C ATOM 1594 CG2 ILE A 102 -6.814 -0.414 -5.684 1.00 0.00 C ATOM 1595 CD1 ILE A 102 -8.505 -1.105 -8.024 1.00 0.00 C ATOM 0 H ILE A 102 -5.296 -0.601 -9.394 1.00 0.00 H new ATOM 0 HA ILE A 102 -7.074 1.116 -7.871 1.00 0.00 H new ATOM 0 HB ILE A 102 -5.215 -1.116 -6.944 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -6.651 -1.894 -8.808 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -7.149 -2.624 -7.295 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -6.891 -1.349 -5.130 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -6.176 0.280 -5.137 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -7.807 0.021 -5.801 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -9.119 -1.820 -8.571 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -8.953 -0.914 -7.049 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -8.446 -0.173 -8.586 1.00 0.00 H new ATOM 1607 N PHE A 103 -3.821 1.368 -7.453 1.00 0.00 N ATOM 1608 CA PHE A 103 -2.775 2.227 -6.823 1.00 0.00 C ATOM 1609 C PHE A 103 -2.983 3.682 -7.248 1.00 0.00 C ATOM 1610 O PHE A 103 -3.116 4.564 -6.421 1.00 0.00 O ATOM 1611 CB PHE A 103 -1.390 1.757 -7.277 1.00 0.00 C ATOM 1612 CG PHE A 103 -0.995 0.521 -6.503 1.00 0.00 C ATOM 1613 CD1 PHE A 103 -0.996 0.540 -5.103 1.00 0.00 C ATOM 1614 CD2 PHE A 103 -0.627 -0.645 -7.187 1.00 0.00 C ATOM 1615 CE1 PHE A 103 -0.629 -0.607 -4.388 1.00 0.00 C ATOM 1616 CE2 PHE A 103 -0.260 -1.790 -6.471 1.00 0.00 C ATOM 1617 CZ PHE A 103 -0.262 -1.771 -5.071 1.00 0.00 C ATOM 0 H PHE A 103 -3.469 0.664 -8.102 1.00 0.00 H new ATOM 0 HA PHE A 103 -2.849 2.152 -5.738 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -1.400 1.541 -8.345 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -0.657 2.548 -7.118 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -1.280 1.438 -4.575 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -0.627 -0.660 -8.267 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -0.629 -0.593 -3.308 1.00 0.00 H new ATOM 0 HE2 PHE A 103 0.025 -2.688 -6.998 1.00 0.00 H new ATOM 0 HZ PHE A 103 0.020 -2.655 -4.519 1.00 0.00 H new ATOM 1627 N THR A 104 -3.013 3.935 -8.532 1.00 0.00 N ATOM 1628 CA THR A 104 -3.213 5.331 -9.022 1.00 0.00 C ATOM 1629 C THR A 104 -4.584 5.844 -8.569 1.00 0.00 C ATOM 1630 O THR A 104 -4.816 7.036 -8.505 1.00 0.00 O ATOM 1631 CB THR A 104 -3.142 5.349 -10.551 1.00 0.00 C ATOM 1632 OG1 THR A 104 -2.086 4.503 -10.984 1.00 0.00 O ATOM 1633 CG2 THR A 104 -2.885 6.777 -11.035 1.00 0.00 C ATOM 0 H THR A 104 -2.907 3.232 -9.264 1.00 0.00 H new ATOM 0 HA THR A 104 -2.433 5.973 -8.613 1.00 0.00 H new ATOM 0 HB THR A 104 -4.086 4.993 -10.963 1.00 0.00 H new ATOM 0 HG1 THR A 104 -1.300 5.046 -11.203 1.00 0.00 H new ATOM 0 HG21 THR A 104 -2.835 6.789 -12.124 1.00 0.00 H new ATOM 0 HG22 THR A 104 -3.696 7.425 -10.702 1.00 0.00 H new ATOM 0 HG23 THR A 104 -1.941 7.136 -10.624 1.00 0.00 H new ATOM 1641 N ALA A 105 -5.488 4.951 -8.256 1.00 0.00 N ATOM 1642 CA ALA A 105 -6.846 5.378 -7.806 1.00 0.00 C ATOM 1643 C ALA A 105 -6.744 6.035 -6.429 1.00 0.00 C ATOM 1644 O ALA A 105 -7.442 6.988 -6.134 1.00 0.00 O ATOM 1645 CB ALA A 105 -7.762 4.155 -7.722 1.00 0.00 C ATOM 0 H ALA A 105 -5.343 3.942 -8.293 1.00 0.00 H new ATOM 0 HA ALA A 105 -7.258 6.092 -8.519 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -8.754 4.465 -7.394 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -7.835 3.687 -8.704 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -7.351 3.441 -7.009 1.00 0.00 H new ATOM 1651 N PHE A 106 -5.879 5.532 -5.584 1.00 0.00 N ATOM 1652 CA PHE A 106 -5.725 6.122 -4.221 1.00 0.00 C ATOM 1653 C PHE A 106 -4.339 6.761 -4.089 1.00 0.00 C ATOM 1654 O PHE A 106 -3.861 6.999 -2.996 1.00 0.00 O ATOM 1655 CB PHE A 106 -5.878 5.020 -3.169 1.00 0.00 C ATOM 1656 CG PHE A 106 -7.332 4.628 -3.056 1.00 0.00 C ATOM 1657 CD1 PHE A 106 -8.193 5.363 -2.233 1.00 0.00 C ATOM 1658 CD2 PHE A 106 -7.819 3.530 -3.775 1.00 0.00 C ATOM 1659 CE1 PHE A 106 -9.540 4.998 -2.127 1.00 0.00 C ATOM 1660 CE2 PHE A 106 -9.166 3.165 -3.669 1.00 0.00 C ATOM 1661 CZ PHE A 106 -10.027 3.899 -2.845 1.00 0.00 C ATOM 0 H PHE A 106 -5.272 4.736 -5.781 1.00 0.00 H new ATOM 0 HA PHE A 106 -6.490 6.883 -4.069 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -5.277 4.153 -3.445 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -5.509 5.370 -2.205 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -7.818 6.212 -1.680 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -7.155 2.964 -4.412 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -10.204 5.564 -1.491 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -9.541 2.317 -4.223 1.00 0.00 H new ATOM 0 HZ PHE A 106 -11.067 3.618 -2.763 1.00 0.00 H new ATOM 1671 N LYS A 107 -3.693 7.039 -5.194 1.00 0.00 N ATOM 1672 CA LYS A 107 -2.337 7.663 -5.139 1.00 0.00 C ATOM 1673 C LYS A 107 -2.448 9.083 -4.577 1.00 0.00 C ATOM 1674 O LYS A 107 -1.497 9.623 -4.044 1.00 0.00 O ATOM 1675 CB LYS A 107 -1.739 7.713 -6.548 1.00 0.00 C ATOM 1676 CG LYS A 107 -2.694 8.453 -7.490 1.00 0.00 C ATOM 1677 CD LYS A 107 -2.279 9.922 -7.590 1.00 0.00 C ATOM 1678 CE LYS A 107 -2.658 10.467 -8.969 1.00 0.00 C ATOM 1679 NZ LYS A 107 -2.504 11.950 -8.977 1.00 0.00 N ATOM 0 H LYS A 107 -4.048 6.860 -6.133 1.00 0.00 H new ATOM 0 HA LYS A 107 -1.691 7.069 -4.493 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -0.773 8.217 -6.525 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -1.563 6.702 -6.915 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -2.677 7.992 -8.477 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -3.717 8.378 -7.120 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -2.770 10.504 -6.810 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -1.205 10.019 -7.431 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -2.024 10.021 -9.735 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -3.686 10.196 -9.209 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -2.761 12.321 -9.914 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -3.127 12.368 -8.256 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -1.516 12.198 -8.766 1.00 0.00 H new ATOM 1693 N ASP A 108 -3.603 9.688 -4.693 1.00 0.00 N ATOM 1694 CA ASP A 108 -3.785 11.074 -4.169 1.00 0.00 C ATOM 1695 C ASP A 108 -3.824 11.039 -2.639 1.00 0.00 C ATOM 1696 O ASP A 108 -3.194 11.842 -1.977 1.00 0.00 O ATOM 1697 CB ASP A 108 -5.098 11.653 -4.701 1.00 0.00 C ATOM 1698 CG ASP A 108 -5.072 13.177 -4.576 1.00 0.00 C ATOM 1699 OD1 ASP A 108 -4.522 13.814 -5.459 1.00 0.00 O ATOM 1700 OD2 ASP A 108 -5.604 13.681 -3.601 1.00 0.00 O ATOM 0 H ASP A 108 -4.430 9.280 -5.129 1.00 0.00 H new ATOM 0 HA ASP A 108 -2.954 11.699 -4.497 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -5.239 11.365 -5.743 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -5.940 11.246 -4.141 1.00 0.00 H new ATOM 1705 N ASP A 109 -4.563 10.116 -2.077 1.00 0.00 N ATOM 1706 CA ASP A 109 -4.651 10.023 -0.591 1.00 0.00 C ATOM 1707 C ASP A 109 -3.634 8.996 -0.082 1.00 0.00 C ATOM 1708 O ASP A 109 -3.906 8.241 0.832 1.00 0.00 O ATOM 1709 CB ASP A 109 -6.062 9.586 -0.190 1.00 0.00 C ATOM 1710 CG ASP A 109 -7.029 10.759 -0.368 1.00 0.00 C ATOM 1711 OD1 ASP A 109 -7.540 10.918 -1.463 1.00 0.00 O ATOM 1712 OD2 ASP A 109 -7.240 11.476 0.596 1.00 0.00 O ATOM 0 H ASP A 109 -5.110 9.422 -2.586 1.00 0.00 H new ATOM 0 HA ASP A 109 -4.434 10.997 -0.153 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -6.381 8.742 -0.802 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -6.069 9.249 0.847 1.00 0.00 H new ATOM 1717 N VAL A 110 -2.466 8.966 -0.671 1.00 0.00 N ATOM 1718 CA VAL A 110 -1.424 7.993 -0.231 1.00 0.00 C ATOM 1719 C VAL A 110 -0.580 8.620 0.888 1.00 0.00 C ATOM 1720 O VAL A 110 -0.426 9.826 0.957 1.00 0.00 O ATOM 1721 CB VAL A 110 -0.533 7.625 -1.429 1.00 0.00 C ATOM 1722 CG1 VAL A 110 0.151 8.882 -1.977 1.00 0.00 C ATOM 1723 CG2 VAL A 110 0.532 6.612 -0.995 1.00 0.00 C ATOM 0 H VAL A 110 -2.189 9.576 -1.440 1.00 0.00 H new ATOM 0 HA VAL A 110 -1.898 7.088 0.149 1.00 0.00 H new ATOM 0 HB VAL A 110 -1.154 7.184 -2.208 1.00 0.00 H new ATOM 0 HG11 VAL A 110 0.780 8.613 -2.825 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -0.606 9.597 -2.299 1.00 0.00 H new ATOM 0 HG13 VAL A 110 0.766 9.331 -1.197 1.00 0.00 H new ATOM 0 HG21 VAL A 110 1.160 6.356 -1.849 1.00 0.00 H new ATOM 0 HG22 VAL A 110 1.149 7.047 -0.209 1.00 0.00 H new ATOM 0 HG23 VAL A 110 0.046 5.712 -0.619 1.00 0.00 H new ATOM 1733 N ASP A 111 -0.037 7.809 1.759 1.00 0.00 N ATOM 1734 CA ASP A 111 0.798 8.345 2.873 1.00 0.00 C ATOM 1735 C ASP A 111 2.094 7.539 2.972 1.00 0.00 C ATOM 1736 O ASP A 111 3.177 8.067 2.806 1.00 0.00 O ATOM 1737 CB ASP A 111 0.025 8.233 4.189 1.00 0.00 C ATOM 1738 CG ASP A 111 -1.190 9.163 4.148 1.00 0.00 C ATOM 1739 OD1 ASP A 111 -1.049 10.268 3.649 1.00 0.00 O ATOM 1740 OD2 ASP A 111 -2.240 8.755 4.617 1.00 0.00 O ATOM 0 H ASP A 111 -0.137 6.794 1.746 1.00 0.00 H new ATOM 0 HA ASP A 111 1.035 9.391 2.679 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -0.297 7.204 4.348 1.00 0.00 H new ATOM 0 HB3 ASP A 111 0.671 8.498 5.026 1.00 0.00 H new ATOM 1745 N THR A 112 1.988 6.262 3.241 1.00 0.00 N ATOM 1746 CA THR A 112 3.208 5.410 3.351 1.00 0.00 C ATOM 1747 C THR A 112 3.497 4.758 1.998 1.00 0.00 C ATOM 1748 O THR A 112 2.628 4.653 1.152 1.00 0.00 O ATOM 1749 CB THR A 112 2.979 4.323 4.404 1.00 0.00 C ATOM 1750 OG1 THR A 112 2.390 4.903 5.560 1.00 0.00 O ATOM 1751 CG2 THR A 112 4.315 3.681 4.777 1.00 0.00 C ATOM 0 H THR A 112 1.105 5.773 3.389 1.00 0.00 H new ATOM 0 HA THR A 112 4.057 6.027 3.646 1.00 0.00 H new ATOM 0 HB THR A 112 2.313 3.560 4.000 1.00 0.00 H new ATOM 0 HG1 THR A 112 2.241 4.208 6.235 1.00 0.00 H new ATOM 0 HG21 THR A 112 4.150 2.907 5.527 1.00 0.00 H new ATOM 0 HG22 THR A 112 4.765 3.236 3.890 1.00 0.00 H new ATOM 0 HG23 THR A 112 4.984 4.441 5.181 1.00 0.00 H new ATOM 1759 N LEU A 113 4.712 4.318 1.788 1.00 0.00 N ATOM 1760 CA LEU A 113 5.067 3.671 0.491 1.00 0.00 C ATOM 1761 C LEU A 113 5.987 2.477 0.750 1.00 0.00 C ATOM 1762 O LEU A 113 7.188 2.625 0.875 1.00 0.00 O ATOM 1763 CB LEU A 113 5.786 4.684 -0.403 1.00 0.00 C ATOM 1764 CG LEU A 113 4.766 5.649 -1.006 1.00 0.00 C ATOM 1765 CD1 LEU A 113 5.487 6.885 -1.545 1.00 0.00 C ATOM 1766 CD2 LEU A 113 4.022 4.955 -2.149 1.00 0.00 C ATOM 0 H LEU A 113 5.475 4.380 2.462 1.00 0.00 H new ATOM 0 HA LEU A 113 4.159 3.328 -0.004 1.00 0.00 H new ATOM 0 HB2 LEU A 113 6.525 5.236 0.177 1.00 0.00 H new ATOM 0 HB3 LEU A 113 6.325 4.166 -1.196 1.00 0.00 H new ATOM 0 HG LEU A 113 4.054 5.951 -0.238 1.00 0.00 H new ATOM 0 HD11 LEU A 113 4.759 7.573 -1.975 1.00 0.00 H new ATOM 0 HD12 LEU A 113 6.018 7.380 -0.732 1.00 0.00 H new ATOM 0 HD13 LEU A 113 6.200 6.584 -2.313 1.00 0.00 H new ATOM 0 HD21 LEU A 113 3.294 5.643 -2.580 1.00 0.00 H new ATOM 0 HD22 LEU A 113 4.735 4.653 -2.917 1.00 0.00 H new ATOM 0 HD23 LEU A 113 3.507 4.074 -1.766 1.00 0.00 H new ATOM 1778 N LEU A 114 5.430 1.296 0.829 1.00 0.00 N ATOM 1779 CA LEU A 114 6.263 0.083 1.078 1.00 0.00 C ATOM 1780 C LEU A 114 6.610 -0.576 -0.259 1.00 0.00 C ATOM 1781 O LEU A 114 5.789 -1.238 -0.865 1.00 0.00 O ATOM 1782 CB LEU A 114 5.480 -0.904 1.946 1.00 0.00 C ATOM 1783 CG LEU A 114 5.231 -0.286 3.322 1.00 0.00 C ATOM 1784 CD1 LEU A 114 4.083 -1.023 4.014 1.00 0.00 C ATOM 1785 CD2 LEU A 114 6.499 -0.407 4.171 1.00 0.00 C ATOM 0 H LEU A 114 4.430 1.120 0.731 1.00 0.00 H new ATOM 0 HA LEU A 114 7.180 0.369 1.593 1.00 0.00 H new ATOM 0 HB2 LEU A 114 4.531 -1.151 1.469 1.00 0.00 H new ATOM 0 HB3 LEU A 114 6.037 -1.835 2.049 1.00 0.00 H new ATOM 0 HG LEU A 114 4.969 0.766 3.205 1.00 0.00 H new ATOM 0 HD11 LEU A 114 3.906 -0.582 4.995 1.00 0.00 H new ATOM 0 HD12 LEU A 114 3.180 -0.938 3.410 1.00 0.00 H new ATOM 0 HD13 LEU A 114 4.344 -2.075 4.131 1.00 0.00 H new ATOM 0 HD21 LEU A 114 6.323 0.033 5.152 1.00 0.00 H new ATOM 0 HD22 LEU A 114 6.760 -1.459 4.287 1.00 0.00 H new ATOM 0 HD23 LEU A 114 7.318 0.118 3.679 1.00 0.00 H new ATOM 1797 N VAL A 115 7.821 -0.396 -0.722 1.00 0.00 N ATOM 1798 CA VAL A 115 8.231 -1.005 -2.021 1.00 0.00 C ATOM 1799 C VAL A 115 9.224 -2.145 -1.760 1.00 0.00 C ATOM 1800 O VAL A 115 10.135 -2.017 -0.964 1.00 0.00 O ATOM 1801 CB VAL A 115 8.877 0.075 -2.904 1.00 0.00 C ATOM 1802 CG1 VAL A 115 10.114 0.649 -2.209 1.00 0.00 C ATOM 1803 CG2 VAL A 115 9.284 -0.531 -4.252 1.00 0.00 C ATOM 0 H VAL A 115 8.545 0.149 -0.254 1.00 0.00 H new ATOM 0 HA VAL A 115 7.359 -1.410 -2.534 1.00 0.00 H new ATOM 0 HB VAL A 115 8.154 0.874 -3.069 1.00 0.00 H new ATOM 0 HG11 VAL A 115 10.565 1.413 -2.842 1.00 0.00 H new ATOM 0 HG12 VAL A 115 9.823 1.092 -1.256 1.00 0.00 H new ATOM 0 HG13 VAL A 115 10.836 -0.149 -2.033 1.00 0.00 H new ATOM 0 HG21 VAL A 115 9.741 0.239 -4.874 1.00 0.00 H new ATOM 0 HG22 VAL A 115 9.999 -1.337 -4.088 1.00 0.00 H new ATOM 0 HG23 VAL A 115 8.401 -0.926 -4.755 1.00 0.00 H new ATOM 1813 N THR A 116 9.053 -3.255 -2.432 1.00 0.00 N ATOM 1814 CA THR A 116 9.981 -4.407 -2.237 1.00 0.00 C ATOM 1815 C THR A 116 10.884 -4.545 -3.464 1.00 0.00 C ATOM 1816 O THR A 116 10.467 -5.036 -4.497 1.00 0.00 O ATOM 1817 CB THR A 116 9.170 -5.693 -2.052 1.00 0.00 C ATOM 1818 OG1 THR A 116 8.156 -5.475 -1.081 1.00 0.00 O ATOM 1819 CG2 THR A 116 10.093 -6.818 -1.585 1.00 0.00 C ATOM 0 H THR A 116 8.307 -3.412 -3.110 1.00 0.00 H new ATOM 0 HA THR A 116 10.593 -4.235 -1.352 1.00 0.00 H new ATOM 0 HB THR A 116 8.712 -5.974 -3.000 1.00 0.00 H new ATOM 0 HG1 THR A 116 8.449 -5.832 -0.217 1.00 0.00 H new ATOM 0 HG21 THR A 116 9.514 -7.732 -1.454 1.00 0.00 H new ATOM 0 HG22 THR A 116 10.870 -6.984 -2.331 1.00 0.00 H new ATOM 0 HG23 THR A 116 10.554 -6.541 -0.637 1.00 0.00 H new ATOM 1827 N ARG A 117 12.114 -4.113 -3.358 1.00 0.00 N ATOM 1828 CA ARG A 117 13.051 -4.211 -4.516 1.00 0.00 C ATOM 1829 C ARG A 117 13.716 -5.589 -4.521 1.00 0.00 C ATOM 1830 O ARG A 117 13.972 -6.167 -3.481 1.00 0.00 O ATOM 1831 CB ARG A 117 14.125 -3.128 -4.395 1.00 0.00 C ATOM 1832 CG ARG A 117 13.546 -1.782 -4.835 1.00 0.00 C ATOM 1833 CD ARG A 117 13.740 -1.611 -6.342 1.00 0.00 C ATOM 1834 NE ARG A 117 15.164 -1.245 -6.622 1.00 0.00 N ATOM 1835 CZ ARG A 117 15.493 -0.584 -7.710 1.00 0.00 C ATOM 1836 NH1 ARG A 117 14.582 -0.225 -8.582 1.00 0.00 N ATOM 1837 NH2 ARG A 117 16.743 -0.281 -7.925 1.00 0.00 N ATOM 0 H ARG A 117 12.511 -3.695 -2.516 1.00 0.00 H new ATOM 0 HA ARG A 117 12.496 -4.072 -5.444 1.00 0.00 H new ATOM 0 HB2 ARG A 117 14.478 -3.065 -3.366 1.00 0.00 H new ATOM 0 HB3 ARG A 117 14.986 -3.385 -5.012 1.00 0.00 H new ATOM 0 HG2 ARG A 117 12.486 -1.731 -4.586 1.00 0.00 H new ATOM 0 HG3 ARG A 117 14.038 -0.970 -4.300 1.00 0.00 H new ATOM 0 HD2 ARG A 117 13.482 -2.535 -6.860 1.00 0.00 H new ATOM 0 HD3 ARG A 117 13.073 -0.836 -6.720 1.00 0.00 H new ATOM 0 HE ARG A 117 15.891 -1.513 -5.958 1.00 0.00 H new ATOM 0 HH11 ARG A 117 13.602 -0.458 -8.421 1.00 0.00 H new ATOM 0 HH12 ARG A 117 14.853 0.287 -9.421 1.00 0.00 H new ATOM 0 HH21 ARG A 117 17.458 -0.557 -7.251 1.00 0.00 H new ATOM 0 HH22 ARG A 117 17.006 0.232 -8.767 1.00 0.00 H new ATOM 1851 N LEU A 118 13.997 -6.115 -5.685 1.00 0.00 N ATOM 1852 CA LEU A 118 14.648 -7.456 -5.773 1.00 0.00 C ATOM 1853 C LEU A 118 15.904 -7.352 -6.643 1.00 0.00 C ATOM 1854 O LEU A 118 15.875 -6.793 -7.722 1.00 0.00 O ATOM 1855 CB LEU A 118 13.670 -8.459 -6.396 1.00 0.00 C ATOM 1856 CG LEU A 118 13.052 -9.328 -5.297 1.00 0.00 C ATOM 1857 CD1 LEU A 118 11.973 -8.533 -4.561 1.00 0.00 C ATOM 1858 CD2 LEU A 118 12.426 -10.574 -5.925 1.00 0.00 C ATOM 0 H LEU A 118 13.803 -5.671 -6.583 1.00 0.00 H new ATOM 0 HA LEU A 118 14.925 -7.796 -4.775 1.00 0.00 H new ATOM 0 HB2 LEU A 118 12.886 -7.929 -6.938 1.00 0.00 H new ATOM 0 HB3 LEU A 118 14.190 -9.087 -7.120 1.00 0.00 H new ATOM 0 HG LEU A 118 13.828 -9.625 -4.591 1.00 0.00 H new ATOM 0 HD11 LEU A 118 11.534 -9.153 -3.779 1.00 0.00 H new ATOM 0 HD12 LEU A 118 12.418 -7.644 -4.113 1.00 0.00 H new ATOM 0 HD13 LEU A 118 11.197 -8.234 -5.266 1.00 0.00 H new ATOM 0 HD21 LEU A 118 11.986 -11.193 -5.143 1.00 0.00 H new ATOM 0 HD22 LEU A 118 11.651 -10.275 -6.631 1.00 0.00 H new ATOM 0 HD23 LEU A 118 13.194 -11.143 -6.449 1.00 0.00 H new ATOM 1870 N ALA A 119 17.003 -7.889 -6.178 1.00 0.00 N ATOM 1871 CA ALA A 119 18.266 -7.826 -6.970 1.00 0.00 C ATOM 1872 C ALA A 119 18.142 -8.728 -8.200 1.00 0.00 C ATOM 1873 O ALA A 119 18.673 -8.430 -9.253 1.00 0.00 O ATOM 1874 CB ALA A 119 19.435 -8.303 -6.105 1.00 0.00 C ATOM 0 H ALA A 119 17.079 -8.369 -5.281 1.00 0.00 H new ATOM 0 HA ALA A 119 18.444 -6.799 -7.288 1.00 0.00 H new ATOM 0 HB1 ALA A 119 20.358 -8.257 -6.683 1.00 0.00 H new ATOM 0 HB2 ALA A 119 19.524 -7.662 -5.228 1.00 0.00 H new ATOM 0 HB3 ALA A 119 19.257 -9.330 -5.787 1.00 0.00 H new ATOM 1880 N GLY A 120 17.442 -9.827 -8.071 1.00 0.00 N ATOM 1881 CA GLY A 120 17.277 -10.755 -9.228 1.00 0.00 C ATOM 1882 C GLY A 120 16.421 -10.085 -10.303 1.00 0.00 C ATOM 1883 O GLY A 120 15.362 -9.556 -10.024 1.00 0.00 O ATOM 0 H GLY A 120 16.977 -10.121 -7.212 1.00 0.00 H new ATOM 0 HA2 GLY A 120 18.252 -11.019 -9.637 1.00 0.00 H new ATOM 0 HA3 GLY A 120 16.807 -11.682 -8.900 1.00 0.00 H new ATOM 1887 N SER A 121 16.875 -10.105 -11.531 1.00 0.00 N ATOM 1888 CA SER A 121 16.094 -9.472 -12.634 1.00 0.00 C ATOM 1889 C SER A 121 14.974 -10.416 -13.073 1.00 0.00 C ATOM 1890 O SER A 121 15.160 -11.615 -13.161 1.00 0.00 O ATOM 1891 CB SER A 121 17.021 -9.195 -13.818 1.00 0.00 C ATOM 1892 OG SER A 121 16.245 -8.767 -14.931 1.00 0.00 O ATOM 0 H SER A 121 17.755 -10.534 -11.816 1.00 0.00 H new ATOM 0 HA SER A 121 15.662 -8.535 -12.283 1.00 0.00 H new ATOM 0 HB2 SER A 121 17.750 -8.430 -13.553 1.00 0.00 H new ATOM 0 HB3 SER A 121 17.581 -10.094 -14.075 1.00 0.00 H new ATOM 0 HG SER A 121 16.836 -8.587 -15.692 1.00 0.00 H new ATOM 1898 N PHE A 122 13.811 -9.881 -13.348 1.00 0.00 N ATOM 1899 CA PHE A 122 12.669 -10.738 -13.782 1.00 0.00 C ATOM 1900 C PHE A 122 11.797 -9.964 -14.772 1.00 0.00 C ATOM 1901 O PHE A 122 11.359 -8.863 -14.494 1.00 0.00 O ATOM 1902 CB PHE A 122 11.833 -11.130 -12.564 1.00 0.00 C ATOM 1903 CG PHE A 122 12.645 -12.030 -11.663 1.00 0.00 C ATOM 1904 CD1 PHE A 122 12.845 -13.371 -12.009 1.00 0.00 C ATOM 1905 CD2 PHE A 122 13.198 -11.522 -10.481 1.00 0.00 C ATOM 1906 CE1 PHE A 122 13.599 -14.206 -11.173 1.00 0.00 C ATOM 1907 CE2 PHE A 122 13.951 -12.356 -9.645 1.00 0.00 C ATOM 1908 CZ PHE A 122 14.151 -13.697 -9.992 1.00 0.00 C ATOM 0 H PHE A 122 13.604 -8.884 -13.290 1.00 0.00 H new ATOM 0 HA PHE A 122 13.053 -11.638 -14.263 1.00 0.00 H new ATOM 0 HB2 PHE A 122 11.523 -10.238 -12.020 1.00 0.00 H new ATOM 0 HB3 PHE A 122 10.924 -11.641 -12.883 1.00 0.00 H new ATOM 0 HD1 PHE A 122 12.418 -13.763 -12.920 1.00 0.00 H new ATOM 0 HD2 PHE A 122 13.044 -10.487 -10.214 1.00 0.00 H new ATOM 0 HE1 PHE A 122 13.754 -15.241 -11.440 1.00 0.00 H new ATOM 0 HE2 PHE A 122 14.377 -11.965 -8.733 1.00 0.00 H new ATOM 0 HZ PHE A 122 14.732 -14.340 -9.348 1.00 0.00 H new ATOM 1918 N GLU A 123 11.545 -10.531 -15.925 1.00 0.00 N ATOM 1919 CA GLU A 123 10.701 -9.836 -16.940 1.00 0.00 C ATOM 1920 C GLU A 123 9.279 -10.397 -16.894 1.00 0.00 C ATOM 1921 O GLU A 123 9.074 -11.567 -16.630 1.00 0.00 O ATOM 1922 CB GLU A 123 11.293 -10.057 -18.334 1.00 0.00 C ATOM 1923 CG GLU A 123 12.545 -9.194 -18.501 1.00 0.00 C ATOM 1924 CD GLU A 123 13.361 -9.703 -19.691 1.00 0.00 C ATOM 1925 OE1 GLU A 123 12.855 -9.645 -20.799 1.00 0.00 O ATOM 1926 OE2 GLU A 123 14.479 -10.140 -19.474 1.00 0.00 O ATOM 0 H GLU A 123 11.890 -11.449 -16.206 1.00 0.00 H new ATOM 0 HA GLU A 123 10.676 -8.768 -16.721 1.00 0.00 H new ATOM 0 HB2 GLU A 123 11.543 -11.109 -18.472 1.00 0.00 H new ATOM 0 HB3 GLU A 123 10.558 -9.801 -19.097 1.00 0.00 H new ATOM 0 HG2 GLU A 123 12.264 -8.153 -18.658 1.00 0.00 H new ATOM 0 HG3 GLU A 123 13.147 -9.228 -17.593 1.00 0.00 H new ATOM 1933 N GLY A 124 8.297 -9.571 -17.150 1.00 0.00 N ATOM 1934 CA GLY A 124 6.882 -10.047 -17.124 1.00 0.00 C ATOM 1935 C GLY A 124 6.080 -9.327 -18.208 1.00 0.00 C ATOM 1936 O GLY A 124 6.428 -9.362 -19.374 1.00 0.00 O ATOM 0 H GLY A 124 8.415 -8.584 -17.377 1.00 0.00 H new ATOM 0 HA2 GLY A 124 6.847 -11.124 -17.286 1.00 0.00 H new ATOM 0 HA3 GLY A 124 6.442 -9.858 -16.145 1.00 0.00 H new ATOM 1940 N ASP A 125 5.009 -8.676 -17.831 1.00 0.00 N ATOM 1941 CA ASP A 125 4.177 -7.948 -18.834 1.00 0.00 C ATOM 1942 C ASP A 125 3.612 -6.675 -18.201 1.00 0.00 C ATOM 1943 O ASP A 125 3.386 -5.686 -18.873 1.00 0.00 O ATOM 1944 CB ASP A 125 3.023 -8.847 -19.287 1.00 0.00 C ATOM 1945 CG ASP A 125 2.249 -9.342 -18.063 1.00 0.00 C ATOM 1946 OD1 ASP A 125 1.392 -8.611 -17.595 1.00 0.00 O ATOM 1947 OD2 ASP A 125 2.527 -10.443 -17.617 1.00 0.00 O ATOM 0 H ASP A 125 4.675 -8.618 -16.869 1.00 0.00 H new ATOM 0 HA ASP A 125 4.793 -7.684 -19.694 1.00 0.00 H new ATOM 0 HB2 ASP A 125 2.358 -8.296 -19.952 1.00 0.00 H new ATOM 0 HB3 ASP A 125 3.409 -9.695 -19.853 1.00 0.00 H new ATOM 1952 N THR A 126 3.383 -6.695 -16.913 1.00 0.00 N ATOM 1953 CA THR A 126 2.833 -5.490 -16.225 1.00 0.00 C ATOM 1954 C THR A 126 3.965 -4.747 -15.513 1.00 0.00 C ATOM 1955 O THR A 126 4.867 -5.353 -14.964 1.00 0.00 O ATOM 1956 CB THR A 126 1.782 -5.923 -15.200 1.00 0.00 C ATOM 1957 OG1 THR A 126 0.962 -6.938 -15.764 1.00 0.00 O ATOM 1958 CG2 THR A 126 0.919 -4.722 -14.813 1.00 0.00 C ATOM 0 H THR A 126 3.554 -7.497 -16.307 1.00 0.00 H new ATOM 0 HA THR A 126 2.373 -4.830 -16.961 1.00 0.00 H new ATOM 0 HB THR A 126 2.279 -6.311 -14.311 1.00 0.00 H new ATOM 0 HG1 THR A 126 1.528 -7.638 -16.151 1.00 0.00 H new ATOM 0 HG21 THR A 126 0.171 -5.032 -14.083 1.00 0.00 H new ATOM 0 HG22 THR A 126 1.549 -3.946 -14.380 1.00 0.00 H new ATOM 0 HG23 THR A 126 0.420 -4.331 -15.700 1.00 0.00 H new ATOM 1966 N LYS A 127 3.922 -3.440 -15.518 1.00 0.00 N ATOM 1967 CA LYS A 127 4.992 -2.647 -14.843 1.00 0.00 C ATOM 1968 C LYS A 127 4.377 -1.820 -13.712 1.00 0.00 C ATOM 1969 O LYS A 127 3.175 -1.813 -13.520 1.00 0.00 O ATOM 1970 CB LYS A 127 5.651 -1.711 -15.859 1.00 0.00 C ATOM 1971 CG LYS A 127 6.322 -2.540 -16.957 1.00 0.00 C ATOM 1972 CD LYS A 127 7.118 -1.617 -17.880 1.00 0.00 C ATOM 1973 CE LYS A 127 8.121 -2.442 -18.688 1.00 0.00 C ATOM 1974 NZ LYS A 127 8.589 -1.649 -19.859 1.00 0.00 N ATOM 0 H LYS A 127 3.190 -2.886 -15.962 1.00 0.00 H new ATOM 0 HA LYS A 127 5.742 -3.324 -14.433 1.00 0.00 H new ATOM 0 HB2 LYS A 127 4.905 -1.047 -16.295 1.00 0.00 H new ATOM 0 HB3 LYS A 127 6.389 -1.080 -15.363 1.00 0.00 H new ATOM 0 HG2 LYS A 127 6.982 -3.285 -16.513 1.00 0.00 H new ATOM 0 HG3 LYS A 127 5.569 -3.082 -17.529 1.00 0.00 H new ATOM 0 HD2 LYS A 127 6.443 -1.087 -18.552 1.00 0.00 H new ATOM 0 HD3 LYS A 127 7.641 -0.862 -17.293 1.00 0.00 H new ATOM 0 HE2 LYS A 127 8.969 -2.719 -18.061 1.00 0.00 H new ATOM 0 HE3 LYS A 127 7.657 -3.369 -19.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 9.271 -2.210 -20.408 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 7.776 -1.406 -20.461 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 9.047 -0.776 -19.527 1.00 0.00 H new ATOM 1988 N MET A 128 5.195 -1.124 -12.964 1.00 0.00 N ATOM 1989 CA MET A 128 4.669 -0.293 -11.842 1.00 0.00 C ATOM 1990 C MET A 128 4.486 1.149 -12.317 1.00 0.00 C ATOM 1991 O MET A 128 5.238 1.641 -13.137 1.00 0.00 O ATOM 1992 CB MET A 128 5.661 -0.324 -10.676 1.00 0.00 C ATOM 1993 CG MET A 128 4.898 -0.249 -9.353 1.00 0.00 C ATOM 1994 SD MET A 128 4.513 1.478 -8.974 1.00 0.00 S ATOM 1995 CE MET A 128 2.956 1.178 -8.101 1.00 0.00 C ATOM 0 H MET A 128 6.208 -1.096 -13.083 1.00 0.00 H new ATOM 0 HA MET A 128 3.709 -0.692 -11.514 1.00 0.00 H new ATOM 0 HB2 MET A 128 6.254 -1.237 -10.714 1.00 0.00 H new ATOM 0 HB3 MET A 128 6.357 0.512 -10.754 1.00 0.00 H new ATOM 0 HG2 MET A 128 3.979 -0.832 -9.418 1.00 0.00 H new ATOM 0 HG3 MET A 128 5.495 -0.684 -8.552 1.00 0.00 H new ATOM 0 HE1 MET A 128 2.553 2.124 -7.741 1.00 0.00 H new ATOM 0 HE2 MET A 128 2.241 0.714 -8.781 1.00 0.00 H new ATOM 0 HE3 MET A 128 3.135 0.514 -7.255 1.00 0.00 H new ATOM 2005 N ILE A 129 3.490 1.829 -11.805 1.00 0.00 N ATOM 2006 CA ILE A 129 3.250 3.242 -12.219 1.00 0.00 C ATOM 2007 C ILE A 129 4.376 4.134 -11.676 1.00 0.00 C ATOM 2008 O ILE A 129 5.103 3.728 -10.791 1.00 0.00 O ATOM 2009 CB ILE A 129 1.907 3.718 -11.657 1.00 0.00 C ATOM 2010 CG1 ILE A 129 1.880 3.490 -10.144 1.00 0.00 C ATOM 2011 CG2 ILE A 129 0.772 2.928 -12.311 1.00 0.00 C ATOM 2012 CD1 ILE A 129 0.687 4.230 -9.538 1.00 0.00 C ATOM 0 H ILE A 129 2.832 1.463 -11.116 1.00 0.00 H new ATOM 0 HA ILE A 129 3.231 3.303 -13.307 1.00 0.00 H new ATOM 0 HB ILE A 129 1.780 4.780 -11.868 1.00 0.00 H new ATOM 0 HG12 ILE A 129 1.809 2.424 -9.927 1.00 0.00 H new ATOM 0 HG13 ILE A 129 2.808 3.845 -9.695 1.00 0.00 H new ATOM 0 HG21 ILE A 129 -0.184 3.266 -11.911 1.00 0.00 H new ATOM 0 HG22 ILE A 129 0.792 3.088 -13.389 1.00 0.00 H new ATOM 0 HG23 ILE A 129 0.899 1.866 -12.099 1.00 0.00 H new ATOM 0 HD11 ILE A 129 0.667 4.068 -8.460 1.00 0.00 H new ATOM 0 HD12 ILE A 129 0.778 5.297 -9.743 1.00 0.00 H new ATOM 0 HD13 ILE A 129 -0.236 3.854 -9.978 1.00 0.00 H new ATOM 2024 N PRO A 130 4.493 5.328 -12.221 1.00 0.00 N ATOM 2025 CA PRO A 130 5.523 6.353 -11.840 1.00 0.00 C ATOM 2026 C PRO A 130 5.087 7.079 -10.564 1.00 0.00 C ATOM 2027 O PRO A 130 4.237 7.950 -10.596 1.00 0.00 O ATOM 2028 CB PRO A 130 5.612 7.335 -13.006 1.00 0.00 C ATOM 2029 CG PRO A 130 4.433 7.066 -13.919 1.00 0.00 C ATOM 2030 CD PRO A 130 3.640 5.910 -13.318 1.00 0.00 C ATOM 0 HA PRO A 130 6.491 5.892 -11.645 1.00 0.00 H new ATOM 0 HB2 PRO A 130 5.590 8.363 -12.644 1.00 0.00 H new ATOM 0 HB3 PRO A 130 6.551 7.207 -13.544 1.00 0.00 H new ATOM 0 HG2 PRO A 130 3.807 7.954 -14.009 1.00 0.00 H new ATOM 0 HG3 PRO A 130 4.775 6.815 -14.923 1.00 0.00 H new ATOM 0 HD2 PRO A 130 2.686 6.259 -12.923 1.00 0.00 H new ATOM 0 HD3 PRO A 130 3.416 5.158 -14.075 1.00 0.00 H new ATOM 2038 N LEU A 131 5.664 6.725 -9.443 1.00 0.00 N ATOM 2039 CA LEU A 131 5.291 7.389 -8.160 1.00 0.00 C ATOM 2040 C LEU A 131 6.141 8.646 -7.968 1.00 0.00 C ATOM 2041 O LEU A 131 7.299 8.683 -8.341 1.00 0.00 O ATOM 2042 CB LEU A 131 5.538 6.425 -6.997 1.00 0.00 C ATOM 2043 CG LEU A 131 4.587 5.232 -7.111 1.00 0.00 C ATOM 2044 CD1 LEU A 131 5.029 4.132 -6.145 1.00 0.00 C ATOM 2045 CD2 LEU A 131 3.166 5.678 -6.758 1.00 0.00 C ATOM 0 H LEU A 131 6.379 6.002 -9.363 1.00 0.00 H new ATOM 0 HA LEU A 131 4.237 7.665 -8.188 1.00 0.00 H new ATOM 0 HB2 LEU A 131 6.572 6.081 -7.009 1.00 0.00 H new ATOM 0 HB3 LEU A 131 5.383 6.937 -6.047 1.00 0.00 H new ATOM 0 HG LEU A 131 4.606 4.849 -8.131 1.00 0.00 H new ATOM 0 HD11 LEU A 131 4.351 3.282 -6.227 1.00 0.00 H new ATOM 0 HD12 LEU A 131 6.041 3.814 -6.394 1.00 0.00 H new ATOM 0 HD13 LEU A 131 5.010 4.515 -5.125 1.00 0.00 H new ATOM 0 HD21 LEU A 131 2.487 4.829 -6.839 1.00 0.00 H new ATOM 0 HD22 LEU A 131 3.148 6.061 -5.738 1.00 0.00 H new ATOM 0 HD23 LEU A 131 2.849 6.462 -7.446 1.00 0.00 H new ATOM 2057 N ASN A 132 5.573 9.675 -7.391 1.00 0.00 N ATOM 2058 CA ASN A 132 6.341 10.934 -7.171 1.00 0.00 C ATOM 2059 C ASN A 132 7.206 10.793 -5.916 1.00 0.00 C ATOM 2060 O ASN A 132 6.811 11.181 -4.834 1.00 0.00 O ATOM 2061 CB ASN A 132 5.367 12.100 -6.988 1.00 0.00 C ATOM 2062 CG ASN A 132 6.084 13.417 -7.290 1.00 0.00 C ATOM 2063 OD1 ASN A 132 6.092 13.874 -8.417 1.00 0.00 O ATOM 2064 ND2 ASN A 132 6.692 14.051 -6.326 1.00 0.00 N ATOM 0 H ASN A 132 4.608 9.695 -7.063 1.00 0.00 H new ATOM 0 HA ASN A 132 6.980 11.124 -8.034 1.00 0.00 H new ATOM 0 HB2 ASN A 132 4.511 11.980 -7.651 1.00 0.00 H new ATOM 0 HB3 ASN A 132 4.982 12.109 -5.968 1.00 0.00 H new ATOM 0 HD21 ASN A 132 7.174 14.929 -6.518 1.00 0.00 H new ATOM 0 HD22 ASN A 132 6.686 13.668 -5.380 1.00 0.00 H new ATOM 2071 N TRP A 133 8.383 10.238 -6.058 1.00 0.00 N ATOM 2072 CA TRP A 133 9.282 10.065 -4.878 1.00 0.00 C ATOM 2073 C TRP A 133 9.835 11.426 -4.441 1.00 0.00 C ATOM 2074 O TRP A 133 10.377 11.563 -3.361 1.00 0.00 O ATOM 2075 CB TRP A 133 10.444 9.143 -5.255 1.00 0.00 C ATOM 2076 CG TRP A 133 9.911 7.792 -5.614 1.00 0.00 C ATOM 2077 CD1 TRP A 133 9.687 7.356 -6.875 1.00 0.00 C ATOM 2078 CD2 TRP A 133 9.534 6.699 -4.728 1.00 0.00 C ATOM 2079 NE1 TRP A 133 9.195 6.064 -6.819 1.00 0.00 N ATOM 2080 CE2 TRP A 133 9.083 5.614 -5.518 1.00 0.00 C ATOM 2081 CE3 TRP A 133 9.537 6.544 -3.330 1.00 0.00 C ATOM 2082 CZ2 TRP A 133 8.652 4.419 -4.942 1.00 0.00 C ATOM 2083 CZ3 TRP A 133 9.105 5.342 -2.747 1.00 0.00 C ATOM 2084 CH2 TRP A 133 8.663 4.282 -3.551 1.00 0.00 C ATOM 0 H TRP A 133 8.760 9.897 -6.942 1.00 0.00 H new ATOM 0 HA TRP A 133 8.716 9.626 -4.057 1.00 0.00 H new ATOM 0 HB2 TRP A 133 10.998 9.563 -6.095 1.00 0.00 H new ATOM 0 HB3 TRP A 133 11.142 9.061 -4.422 1.00 0.00 H new ATOM 0 HD1 TRP A 133 9.863 7.923 -7.777 1.00 0.00 H new ATOM 0 HE1 TRP A 133 8.945 5.511 -7.639 1.00 0.00 H new ATOM 0 HE3 TRP A 133 9.874 7.355 -2.701 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 8.312 3.606 -5.566 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 9.113 5.233 -1.673 1.00 0.00 H new ATOM 0 HH2 TRP A 133 8.331 3.360 -3.096 1.00 0.00 H new ATOM 2095 N ASP A 134 9.701 12.430 -5.271 1.00 0.00 N ATOM 2096 CA ASP A 134 10.218 13.785 -4.908 1.00 0.00 C ATOM 2097 C ASP A 134 9.303 14.429 -3.858 1.00 0.00 C ATOM 2098 O ASP A 134 9.431 15.600 -3.553 1.00 0.00 O ATOM 2099 CB ASP A 134 10.255 14.665 -6.158 1.00 0.00 C ATOM 2100 CG ASP A 134 11.640 14.576 -6.804 1.00 0.00 C ATOM 2101 OD1 ASP A 134 12.614 14.558 -6.069 1.00 0.00 O ATOM 2102 OD2 ASP A 134 11.703 14.529 -8.022 1.00 0.00 O ATOM 0 H ASP A 134 9.255 12.369 -6.186 1.00 0.00 H new ATOM 0 HA ASP A 134 11.223 13.688 -4.497 1.00 0.00 H new ATOM 0 HB2 ASP A 134 9.491 14.343 -6.865 1.00 0.00 H new ATOM 0 HB3 ASP A 134 10.030 15.699 -5.895 1.00 0.00 H new ATOM 2107 N ASP A 135 8.385 13.675 -3.306 1.00 0.00 N ATOM 2108 CA ASP A 135 7.464 14.240 -2.277 1.00 0.00 C ATOM 2109 C ASP A 135 7.351 13.264 -1.105 1.00 0.00 C ATOM 2110 O ASP A 135 6.322 13.172 -0.461 1.00 0.00 O ATOM 2111 CB ASP A 135 6.082 14.459 -2.895 1.00 0.00 C ATOM 2112 CG ASP A 135 6.051 15.809 -3.613 1.00 0.00 C ATOM 2113 OD1 ASP A 135 6.902 16.027 -4.459 1.00 0.00 O ATOM 2114 OD2 ASP A 135 5.175 16.601 -3.306 1.00 0.00 O ATOM 0 H ASP A 135 8.235 12.690 -3.525 1.00 0.00 H new ATOM 0 HA ASP A 135 7.856 15.192 -1.920 1.00 0.00 H new ATOM 0 HB2 ASP A 135 5.855 13.657 -3.597 1.00 0.00 H new ATOM 0 HB3 ASP A 135 5.317 14.430 -2.119 1.00 0.00 H new ATOM 2119 N PHE A 136 8.401 12.535 -0.827 1.00 0.00 N ATOM 2120 CA PHE A 136 8.365 11.559 0.302 1.00 0.00 C ATOM 2121 C PHE A 136 9.714 11.568 1.025 1.00 0.00 C ATOM 2122 O PHE A 136 10.651 12.215 0.600 1.00 0.00 O ATOM 2123 CB PHE A 136 8.089 10.157 -0.243 1.00 0.00 C ATOM 2124 CG PHE A 136 6.635 10.046 -0.635 1.00 0.00 C ATOM 2125 CD1 PHE A 136 5.670 9.748 0.335 1.00 0.00 C ATOM 2126 CD2 PHE A 136 6.252 10.243 -1.967 1.00 0.00 C ATOM 2127 CE1 PHE A 136 4.322 9.645 -0.029 1.00 0.00 C ATOM 2128 CE2 PHE A 136 4.905 10.141 -2.330 1.00 0.00 C ATOM 2129 CZ PHE A 136 3.939 9.842 -1.361 1.00 0.00 C ATOM 0 H PHE A 136 9.284 12.574 -1.335 1.00 0.00 H new ATOM 0 HA PHE A 136 7.575 11.839 0.999 1.00 0.00 H new ATOM 0 HB2 PHE A 136 8.725 9.959 -1.106 1.00 0.00 H new ATOM 0 HB3 PHE A 136 8.332 9.408 0.511 1.00 0.00 H new ATOM 0 HD1 PHE A 136 5.965 9.598 1.363 1.00 0.00 H new ATOM 0 HD2 PHE A 136 6.997 10.474 -2.714 1.00 0.00 H new ATOM 0 HE1 PHE A 136 3.577 9.413 0.718 1.00 0.00 H new ATOM 0 HE2 PHE A 136 4.610 10.293 -3.358 1.00 0.00 H new ATOM 0 HZ PHE A 136 2.899 9.763 -1.641 1.00 0.00 H new ATOM 2139 N THR A 137 9.814 10.852 2.117 1.00 0.00 N ATOM 2140 CA THR A 137 11.098 10.811 2.877 1.00 0.00 C ATOM 2141 C THR A 137 11.261 9.437 3.527 1.00 0.00 C ATOM 2142 O THR A 137 10.324 8.884 4.072 1.00 0.00 O ATOM 2143 CB THR A 137 11.083 11.891 3.961 1.00 0.00 C ATOM 2144 OG1 THR A 137 10.604 13.109 3.409 1.00 0.00 O ATOM 2145 CG2 THR A 137 12.499 12.094 4.502 1.00 0.00 C ATOM 0 H THR A 137 9.059 10.293 2.515 1.00 0.00 H new ATOM 0 HA THR A 137 11.930 10.991 2.196 1.00 0.00 H new ATOM 0 HB THR A 137 10.428 11.580 4.775 1.00 0.00 H new ATOM 0 HG1 THR A 137 10.593 13.801 4.103 1.00 0.00 H new ATOM 0 HG21 THR A 137 12.487 12.863 5.274 1.00 0.00 H new ATOM 0 HG22 THR A 137 12.863 11.159 4.927 1.00 0.00 H new ATOM 0 HG23 THR A 137 13.157 12.404 3.691 1.00 0.00 H new ATOM 2153 N LYS A 138 12.446 8.882 3.473 1.00 0.00 N ATOM 2154 CA LYS A 138 12.681 7.541 4.086 1.00 0.00 C ATOM 2155 C LYS A 138 12.648 7.665 5.610 1.00 0.00 C ATOM 2156 O LYS A 138 12.876 8.727 6.159 1.00 0.00 O ATOM 2157 CB LYS A 138 14.048 7.013 3.646 1.00 0.00 C ATOM 2158 CG LYS A 138 14.133 5.513 3.937 1.00 0.00 C ATOM 2159 CD LYS A 138 15.427 4.951 3.346 1.00 0.00 C ATOM 2160 CE LYS A 138 15.298 4.863 1.824 1.00 0.00 C ATOM 2161 NZ LYS A 138 16.367 3.976 1.286 1.00 0.00 N ATOM 0 H LYS A 138 13.263 9.302 3.029 1.00 0.00 H new ATOM 0 HA LYS A 138 11.903 6.850 3.761 1.00 0.00 H new ATOM 0 HB2 LYS A 138 14.195 7.197 2.582 1.00 0.00 H new ATOM 0 HB3 LYS A 138 14.841 7.542 4.174 1.00 0.00 H new ATOM 0 HG2 LYS A 138 14.106 5.338 5.013 1.00 0.00 H new ATOM 0 HG3 LYS A 138 13.272 4.999 3.509 1.00 0.00 H new ATOM 0 HD2 LYS A 138 16.269 5.590 3.614 1.00 0.00 H new ATOM 0 HD3 LYS A 138 15.631 3.964 3.762 1.00 0.00 H new ATOM 0 HE2 LYS A 138 14.317 4.473 1.553 1.00 0.00 H new ATOM 0 HE3 LYS A 138 15.379 5.857 1.383 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 15.977 3.384 0.525 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 17.143 4.557 0.909 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 16.729 3.367 2.048 1.00 0.00 H new ATOM 2175 N VAL A 139 12.366 6.586 6.295 1.00 0.00 N ATOM 2176 CA VAL A 139 12.315 6.630 7.786 1.00 0.00 C ATOM 2177 C VAL A 139 12.837 5.309 8.353 1.00 0.00 C ATOM 2178 O VAL A 139 13.485 5.280 9.383 1.00 0.00 O ATOM 2179 CB VAL A 139 10.871 6.847 8.240 1.00 0.00 C ATOM 2180 CG1 VAL A 139 10.400 8.235 7.802 1.00 0.00 C ATOM 2181 CG2 VAL A 139 9.971 5.782 7.609 1.00 0.00 C ATOM 0 H VAL A 139 12.168 5.674 5.883 1.00 0.00 H new ATOM 0 HA VAL A 139 12.936 7.450 8.148 1.00 0.00 H new ATOM 0 HB VAL A 139 10.818 6.771 9.326 1.00 0.00 H new ATOM 0 HG11 VAL A 139 9.371 8.389 8.126 1.00 0.00 H new ATOM 0 HG12 VAL A 139 11.039 8.995 8.251 1.00 0.00 H new ATOM 0 HG13 VAL A 139 10.454 8.312 6.716 1.00 0.00 H new ATOM 0 HG21 VAL A 139 8.942 5.937 7.933 1.00 0.00 H new ATOM 0 HG22 VAL A 139 10.025 5.857 6.523 1.00 0.00 H new ATOM 0 HG23 VAL A 139 10.304 4.792 7.921 1.00 0.00 H new ATOM 2191 N SER A 140 12.557 4.216 7.690 1.00 0.00 N ATOM 2192 CA SER A 140 13.032 2.890 8.183 1.00 0.00 C ATOM 2193 C SER A 140 13.301 1.969 6.992 1.00 0.00 C ATOM 2194 O SER A 140 12.859 2.225 5.887 1.00 0.00 O ATOM 2195 CB SER A 140 11.962 2.266 9.077 1.00 0.00 C ATOM 2196 OG SER A 140 12.017 2.865 10.365 1.00 0.00 O ATOM 0 H SER A 140 12.017 4.186 6.825 1.00 0.00 H new ATOM 0 HA SER A 140 13.951 3.023 8.754 1.00 0.00 H new ATOM 0 HB2 SER A 140 10.975 2.411 8.638 1.00 0.00 H new ATOM 0 HB3 SER A 140 12.120 1.191 9.157 1.00 0.00 H new ATOM 0 HG SER A 140 12.578 3.668 10.329 1.00 0.00 H new ATOM 2202 N SER A 141 14.024 0.899 7.210 1.00 0.00 N ATOM 2203 CA SER A 141 14.328 -0.046 6.097 1.00 0.00 C ATOM 2204 C SER A 141 14.701 -1.413 6.675 1.00 0.00 C ATOM 2205 O SER A 141 15.110 -1.521 7.815 1.00 0.00 O ATOM 2206 CB SER A 141 15.498 0.494 5.273 1.00 0.00 C ATOM 2207 OG SER A 141 15.664 -0.307 4.111 1.00 0.00 O ATOM 0 H SER A 141 14.417 0.640 8.115 1.00 0.00 H new ATOM 0 HA SER A 141 13.450 -0.148 5.459 1.00 0.00 H new ATOM 0 HB2 SER A 141 15.311 1.530 4.991 1.00 0.00 H new ATOM 0 HB3 SER A 141 16.411 0.485 5.868 1.00 0.00 H new ATOM 0 HG SER A 141 16.412 0.038 3.580 1.00 0.00 H new ATOM 2213 N ARG A 142 14.562 -2.455 5.894 1.00 0.00 N ATOM 2214 CA ARG A 142 14.906 -3.820 6.390 1.00 0.00 C ATOM 2215 C ARG A 142 15.543 -4.629 5.258 1.00 0.00 C ATOM 2216 O ARG A 142 14.860 -5.138 4.389 1.00 0.00 O ATOM 2217 CB ARG A 142 13.634 -4.525 6.867 1.00 0.00 C ATOM 2218 CG ARG A 142 14.011 -5.763 7.681 1.00 0.00 C ATOM 2219 CD ARG A 142 12.799 -6.232 8.490 1.00 0.00 C ATOM 2220 NE ARG A 142 13.256 -7.120 9.604 1.00 0.00 N ATOM 2221 CZ ARG A 142 12.432 -7.974 10.171 1.00 0.00 C ATOM 2222 NH1 ARG A 142 11.186 -8.071 9.777 1.00 0.00 N ATOM 2223 NH2 ARG A 142 12.860 -8.735 11.140 1.00 0.00 N ATOM 0 H ARG A 142 14.224 -2.418 4.932 1.00 0.00 H new ATOM 0 HA ARG A 142 15.609 -3.739 7.219 1.00 0.00 H new ATOM 0 HB2 ARG A 142 13.035 -3.846 7.474 1.00 0.00 H new ATOM 0 HB3 ARG A 142 13.022 -4.812 6.012 1.00 0.00 H new ATOM 0 HG2 ARG A 142 14.348 -6.559 7.017 1.00 0.00 H new ATOM 0 HG3 ARG A 142 14.841 -5.533 8.349 1.00 0.00 H new ATOM 0 HD2 ARG A 142 12.262 -5.373 8.892 1.00 0.00 H new ATOM 0 HD3 ARG A 142 12.103 -6.769 7.845 1.00 0.00 H new ATOM 0 HE ARG A 142 14.221 -7.062 9.929 1.00 0.00 H new ATOM 0 HH11 ARG A 142 10.843 -7.479 9.020 1.00 0.00 H new ATOM 0 HH12 ARG A 142 10.559 -8.738 10.227 1.00 0.00 H new ATOM 0 HH21 ARG A 142 13.828 -8.665 11.453 1.00 0.00 H new ATOM 0 HH22 ARG A 142 12.227 -9.400 11.584 1.00 0.00 H new ATOM 2237 N THR A 143 16.846 -4.748 5.264 1.00 0.00 N ATOM 2238 CA THR A 143 17.539 -5.522 4.192 1.00 0.00 C ATOM 2239 C THR A 143 17.563 -7.004 4.569 1.00 0.00 C ATOM 2240 O THR A 143 17.712 -7.355 5.725 1.00 0.00 O ATOM 2241 CB THR A 143 18.974 -5.010 4.038 1.00 0.00 C ATOM 2242 OG1 THR A 143 18.975 -3.590 4.086 1.00 0.00 O ATOM 2243 CG2 THR A 143 19.544 -5.478 2.699 1.00 0.00 C ATOM 0 H THR A 143 17.461 -4.341 5.968 1.00 0.00 H new ATOM 0 HA THR A 143 17.006 -5.395 3.250 1.00 0.00 H new ATOM 0 HB THR A 143 19.589 -5.402 4.848 1.00 0.00 H new ATOM 0 HG1 THR A 143 19.893 -3.260 3.989 1.00 0.00 H new ATOM 0 HG21 THR A 143 20.565 -5.113 2.591 1.00 0.00 H new ATOM 0 HG22 THR A 143 19.542 -6.567 2.664 1.00 0.00 H new ATOM 0 HG23 THR A 143 18.931 -5.088 1.886 1.00 0.00 H new ATOM 2251 N VAL A 144 17.418 -7.874 3.603 1.00 0.00 N ATOM 2252 CA VAL A 144 17.431 -9.337 3.895 1.00 0.00 C ATOM 2253 C VAL A 144 18.050 -10.087 2.709 1.00 0.00 C ATOM 2254 O VAL A 144 17.660 -9.897 1.572 1.00 0.00 O ATOM 2255 CB VAL A 144 15.990 -9.816 4.139 1.00 0.00 C ATOM 2256 CG1 VAL A 144 15.134 -9.558 2.896 1.00 0.00 C ATOM 2257 CG2 VAL A 144 15.989 -11.316 4.457 1.00 0.00 C ATOM 0 H VAL A 144 17.291 -7.632 2.620 1.00 0.00 H new ATOM 0 HA VAL A 144 18.027 -9.535 4.786 1.00 0.00 H new ATOM 0 HB VAL A 144 15.573 -9.265 4.982 1.00 0.00 H new ATOM 0 HG11 VAL A 144 14.115 -9.900 3.078 1.00 0.00 H new ATOM 0 HG12 VAL A 144 15.124 -8.490 2.676 1.00 0.00 H new ATOM 0 HG13 VAL A 144 15.552 -10.099 2.047 1.00 0.00 H new ATOM 0 HG21 VAL A 144 14.966 -11.651 4.629 1.00 0.00 H new ATOM 0 HG22 VAL A 144 16.414 -11.866 3.618 1.00 0.00 H new ATOM 0 HG23 VAL A 144 16.586 -11.499 5.351 1.00 0.00 H new ATOM 2267 N GLU A 145 19.012 -10.937 2.971 1.00 0.00 N ATOM 2268 CA GLU A 145 19.662 -11.703 1.867 1.00 0.00 C ATOM 2269 C GLU A 145 19.171 -13.152 1.894 1.00 0.00 C ATOM 2270 O GLU A 145 19.328 -13.851 2.879 1.00 0.00 O ATOM 2271 CB GLU A 145 21.181 -11.676 2.053 1.00 0.00 C ATOM 2272 CG GLU A 145 21.864 -12.046 0.735 1.00 0.00 C ATOM 2273 CD GLU A 145 23.382 -11.991 0.912 1.00 0.00 C ATOM 2274 OE1 GLU A 145 23.929 -12.927 1.472 1.00 0.00 O ATOM 2275 OE2 GLU A 145 23.973 -11.012 0.486 1.00 0.00 O ATOM 0 H GLU A 145 19.375 -11.133 3.904 1.00 0.00 H new ATOM 0 HA GLU A 145 19.405 -11.250 0.910 1.00 0.00 H new ATOM 0 HB2 GLU A 145 21.501 -10.685 2.375 1.00 0.00 H new ATOM 0 HB3 GLU A 145 21.475 -12.375 2.836 1.00 0.00 H new ATOM 0 HG2 GLU A 145 21.560 -13.045 0.424 1.00 0.00 H new ATOM 0 HG3 GLU A 145 21.554 -11.359 -0.052 1.00 0.00 H new ATOM 2282 N ASP A 146 18.579 -13.606 0.819 1.00 0.00 N ATOM 2283 CA ASP A 146 18.073 -15.009 0.772 1.00 0.00 C ATOM 2284 C ASP A 146 19.235 -15.960 0.475 1.00 0.00 C ATOM 2285 O ASP A 146 20.390 -15.586 0.561 1.00 0.00 O ATOM 2286 CB ASP A 146 17.016 -15.134 -0.327 1.00 0.00 C ATOM 2287 CG ASP A 146 16.108 -16.328 -0.029 1.00 0.00 C ATOM 2288 OD1 ASP A 146 15.575 -16.382 1.066 1.00 0.00 O ATOM 2289 OD2 ASP A 146 15.961 -17.169 -0.902 1.00 0.00 O ATOM 0 H ASP A 146 18.424 -13.063 -0.030 1.00 0.00 H new ATOM 0 HA ASP A 146 17.629 -15.268 1.733 1.00 0.00 H new ATOM 0 HB2 ASP A 146 16.425 -14.220 -0.384 1.00 0.00 H new ATOM 0 HB3 ASP A 146 17.498 -15.263 -1.296 1.00 0.00 H new ATOM 2294 N THR A 147 18.935 -17.186 0.126 1.00 0.00 N ATOM 2295 CA THR A 147 20.015 -18.170 -0.178 1.00 0.00 C ATOM 2296 C THR A 147 20.700 -17.791 -1.494 1.00 0.00 C ATOM 2297 O THR A 147 21.904 -17.894 -1.626 1.00 0.00 O ATOM 2298 CB THR A 147 19.408 -19.569 -0.304 1.00 0.00 C ATOM 2299 OG1 THR A 147 18.129 -19.475 -0.914 1.00 0.00 O ATOM 2300 CG2 THR A 147 19.269 -20.194 1.085 1.00 0.00 C ATOM 0 H THR A 147 17.985 -17.547 0.039 1.00 0.00 H new ATOM 0 HA THR A 147 20.749 -18.162 0.627 1.00 0.00 H new ATOM 0 HB THR A 147 20.058 -20.194 -0.917 1.00 0.00 H new ATOM 0 HG1 THR A 147 17.739 -20.370 -0.997 1.00 0.00 H new ATOM 0 HG21 THR A 147 18.837 -21.190 0.994 1.00 0.00 H new ATOM 0 HG22 THR A 147 20.251 -20.266 1.552 1.00 0.00 H new ATOM 0 HG23 THR A 147 18.620 -19.572 1.701 1.00 0.00 H new ATOM 2308 N ASN A 148 19.937 -17.354 -2.465 1.00 0.00 N ATOM 2309 CA ASN A 148 20.536 -16.969 -3.777 1.00 0.00 C ATOM 2310 C ASN A 148 20.557 -15.435 -3.898 1.00 0.00 C ATOM 2311 O ASN A 148 19.596 -14.786 -3.537 1.00 0.00 O ATOM 2312 CB ASN A 148 19.692 -17.557 -4.910 1.00 0.00 C ATOM 2313 CG ASN A 148 20.519 -17.598 -6.197 1.00 0.00 C ATOM 2314 OD1 ASN A 148 20.785 -16.574 -6.794 1.00 0.00 O ATOM 2315 ND2 ASN A 148 20.938 -18.747 -6.653 1.00 0.00 N ATOM 0 H ASN A 148 18.924 -17.248 -2.404 1.00 0.00 H new ATOM 0 HA ASN A 148 21.554 -17.353 -3.842 1.00 0.00 H new ATOM 0 HB2 ASN A 148 19.360 -18.561 -4.647 1.00 0.00 H new ATOM 0 HB3 ASN A 148 18.796 -16.955 -5.060 1.00 0.00 H new ATOM 0 HD21 ASN A 148 21.489 -18.785 -7.511 1.00 0.00 H new ATOM 0 HD22 ASN A 148 20.715 -19.607 -6.152 1.00 0.00 H new ATOM 2322 N PRO A 149 21.649 -14.887 -4.402 1.00 0.00 N ATOM 2323 CA PRO A 149 21.857 -13.409 -4.600 1.00 0.00 C ATOM 2324 C PRO A 149 20.635 -12.794 -5.292 1.00 0.00 C ATOM 2325 O PRO A 149 20.145 -11.754 -4.896 1.00 0.00 O ATOM 2326 CB PRO A 149 23.098 -13.241 -5.478 1.00 0.00 C ATOM 2327 CG PRO A 149 23.711 -14.609 -5.677 1.00 0.00 C ATOM 2328 CD PRO A 149 22.890 -15.608 -4.872 1.00 0.00 C ATOM 0 HA PRO A 149 21.990 -12.905 -3.643 1.00 0.00 H new ATOM 0 HB2 PRO A 149 22.830 -12.799 -6.438 1.00 0.00 H new ATOM 0 HB3 PRO A 149 23.812 -12.567 -5.005 1.00 0.00 H new ATOM 0 HG2 PRO A 149 23.711 -14.878 -6.733 1.00 0.00 H new ATOM 0 HG3 PRO A 149 24.750 -14.614 -5.347 1.00 0.00 H new ATOM 0 HD2 PRO A 149 22.626 -16.471 -5.483 1.00 0.00 H new ATOM 0 HD3 PRO A 149 23.463 -15.982 -4.023 1.00 0.00 H new ATOM 2336 N ALA A 150 20.144 -13.434 -6.325 1.00 0.00 N ATOM 2337 CA ALA A 150 18.957 -12.897 -7.052 1.00 0.00 C ATOM 2338 C ALA A 150 17.754 -12.844 -6.107 1.00 0.00 C ATOM 2339 O ALA A 150 16.883 -12.005 -6.245 1.00 0.00 O ATOM 2340 CB ALA A 150 18.632 -13.806 -8.238 1.00 0.00 C ATOM 0 H ALA A 150 20.517 -14.308 -6.695 1.00 0.00 H new ATOM 0 HA ALA A 150 19.179 -11.892 -7.412 1.00 0.00 H new ATOM 0 HB1 ALA A 150 17.765 -13.414 -8.770 1.00 0.00 H new ATOM 0 HB2 ALA A 150 19.486 -13.842 -8.914 1.00 0.00 H new ATOM 0 HB3 ALA A 150 18.413 -14.811 -7.877 1.00 0.00 H new ATOM 2346 N LEU A 151 17.701 -13.735 -5.149 1.00 0.00 N ATOM 2347 CA LEU A 151 16.557 -13.744 -4.190 1.00 0.00 C ATOM 2348 C LEU A 151 16.787 -12.689 -3.105 1.00 0.00 C ATOM 2349 O LEU A 151 16.211 -12.753 -2.036 1.00 0.00 O ATOM 2350 CB LEU A 151 16.446 -15.126 -3.542 1.00 0.00 C ATOM 2351 CG LEU A 151 15.752 -16.087 -4.508 1.00 0.00 C ATOM 2352 CD1 LEU A 151 15.877 -17.519 -3.983 1.00 0.00 C ATOM 2353 CD2 LEU A 151 14.272 -15.714 -4.621 1.00 0.00 C ATOM 0 H LEU A 151 18.403 -14.458 -4.990 1.00 0.00 H new ATOM 0 HA LEU A 151 15.635 -13.517 -4.725 1.00 0.00 H new ATOM 0 HB2 LEU A 151 17.437 -15.501 -3.288 1.00 0.00 H new ATOM 0 HB3 LEU A 151 15.883 -15.059 -2.611 1.00 0.00 H new ATOM 0 HG LEU A 151 16.222 -16.018 -5.489 1.00 0.00 H new ATOM 0 HD11 LEU A 151 15.382 -18.204 -4.672 1.00 0.00 H new ATOM 0 HD12 LEU A 151 16.931 -17.786 -3.901 1.00 0.00 H new ATOM 0 HD13 LEU A 151 15.407 -17.589 -3.002 1.00 0.00 H new ATOM 0 HD21 LEU A 151 13.776 -16.398 -5.309 1.00 0.00 H new ATOM 0 HD22 LEU A 151 13.803 -15.784 -3.639 1.00 0.00 H new ATOM 0 HD23 LEU A 151 14.181 -14.694 -4.995 1.00 0.00 H new ATOM 2365 N THR A 152 17.624 -11.718 -3.375 1.00 0.00 N ATOM 2366 CA THR A 152 17.896 -10.653 -2.364 1.00 0.00 C ATOM 2367 C THR A 152 16.925 -9.490 -2.579 1.00 0.00 C ATOM 2368 O THR A 152 16.659 -9.092 -3.698 1.00 0.00 O ATOM 2369 CB THR A 152 19.335 -10.156 -2.524 1.00 0.00 C ATOM 2370 OG1 THR A 152 20.226 -11.261 -2.455 1.00 0.00 O ATOM 2371 CG2 THR A 152 19.663 -9.165 -1.405 1.00 0.00 C ATOM 0 H THR A 152 18.131 -11.618 -4.254 1.00 0.00 H new ATOM 0 HA THR A 152 17.762 -11.057 -1.361 1.00 0.00 H new ATOM 0 HB THR A 152 19.443 -9.660 -3.489 1.00 0.00 H new ATOM 0 HG1 THR A 152 20.648 -11.396 -3.329 1.00 0.00 H new ATOM 0 HG21 THR A 152 20.688 -8.812 -1.520 1.00 0.00 H new ATOM 0 HG22 THR A 152 18.979 -8.318 -1.457 1.00 0.00 H new ATOM 0 HG23 THR A 152 19.556 -9.658 -0.439 1.00 0.00 H new ATOM 2379 N HIS A 153 16.396 -8.944 -1.514 1.00 0.00 N ATOM 2380 CA HIS A 153 15.440 -7.805 -1.646 1.00 0.00 C ATOM 2381 C HIS A 153 15.512 -6.928 -0.393 1.00 0.00 C ATOM 2382 O HIS A 153 16.111 -7.298 0.600 1.00 0.00 O ATOM 2383 CB HIS A 153 14.017 -8.345 -1.810 1.00 0.00 C ATOM 2384 CG HIS A 153 13.700 -9.294 -0.685 1.00 0.00 C ATOM 2385 ND1 HIS A 153 14.246 -10.567 -0.617 1.00 0.00 N ATOM 2386 CD2 HIS A 153 12.898 -9.170 0.422 1.00 0.00 C ATOM 2387 CE1 HIS A 153 13.769 -11.154 0.496 1.00 0.00 C ATOM 2388 NE2 HIS A 153 12.943 -10.345 1.166 1.00 0.00 N ATOM 0 H HIS A 153 16.586 -9.239 -0.556 1.00 0.00 H new ATOM 0 HA HIS A 153 15.705 -7.211 -2.521 1.00 0.00 H new ATOM 0 HB2 HIS A 153 13.304 -7.521 -1.815 1.00 0.00 H new ATOM 0 HB3 HIS A 153 13.920 -8.856 -2.768 1.00 0.00 H new ATOM 0 HD1 HIS A 153 14.892 -10.983 -1.288 1.00 0.00 H new ATOM 0 HD2 HIS A 153 12.320 -8.294 0.677 1.00 0.00 H new ATOM 0 HE1 HIS A 153 14.023 -12.156 0.809 1.00 0.00 H new ATOM 2396 N THR A 154 14.904 -5.770 -0.436 1.00 0.00 N ATOM 2397 CA THR A 154 14.928 -4.860 0.745 1.00 0.00 C ATOM 2398 C THR A 154 13.576 -4.155 0.872 1.00 0.00 C ATOM 2399 O THR A 154 13.045 -3.638 -0.092 1.00 0.00 O ATOM 2400 CB THR A 154 16.034 -3.816 0.564 1.00 0.00 C ATOM 2401 OG1 THR A 154 17.249 -4.470 0.226 1.00 0.00 O ATOM 2402 CG2 THR A 154 16.217 -3.033 1.865 1.00 0.00 C ATOM 0 H THR A 154 14.390 -5.416 -1.243 1.00 0.00 H new ATOM 0 HA THR A 154 15.122 -5.440 1.647 1.00 0.00 H new ATOM 0 HB THR A 154 15.758 -3.128 -0.235 1.00 0.00 H new ATOM 0 HG1 THR A 154 17.958 -3.803 0.108 1.00 0.00 H new ATOM 0 HG21 THR A 154 17.004 -2.290 1.735 1.00 0.00 H new ATOM 0 HG22 THR A 154 15.284 -2.532 2.122 1.00 0.00 H new ATOM 0 HG23 THR A 154 16.493 -3.718 2.666 1.00 0.00 H new ATOM 2410 N TYR A 155 13.018 -4.135 2.056 1.00 0.00 N ATOM 2411 CA TYR A 155 11.699 -3.467 2.256 1.00 0.00 C ATOM 2412 C TYR A 155 11.920 -1.996 2.611 1.00 0.00 C ATOM 2413 O TYR A 155 12.234 -1.661 3.738 1.00 0.00 O ATOM 2414 CB TYR A 155 10.944 -4.159 3.394 1.00 0.00 C ATOM 2415 CG TYR A 155 10.630 -5.581 2.999 1.00 0.00 C ATOM 2416 CD1 TYR A 155 9.484 -5.862 2.245 1.00 0.00 C ATOM 2417 CD2 TYR A 155 11.485 -6.621 3.387 1.00 0.00 C ATOM 2418 CE1 TYR A 155 9.193 -7.181 1.878 1.00 0.00 C ATOM 2419 CE2 TYR A 155 11.193 -7.940 3.021 1.00 0.00 C ATOM 2420 CZ TYR A 155 10.047 -8.221 2.266 1.00 0.00 C ATOM 2421 OH TYR A 155 9.760 -9.521 1.905 1.00 0.00 O ATOM 0 H TYR A 155 13.421 -4.554 2.894 1.00 0.00 H new ATOM 0 HA TYR A 155 11.115 -3.535 1.338 1.00 0.00 H new ATOM 0 HB2 TYR A 155 11.545 -4.147 4.303 1.00 0.00 H new ATOM 0 HB3 TYR A 155 10.023 -3.620 3.614 1.00 0.00 H new ATOM 0 HD1 TYR A 155 8.824 -5.061 1.947 1.00 0.00 H new ATOM 0 HD2 TYR A 155 12.369 -6.405 3.968 1.00 0.00 H new ATOM 0 HE1 TYR A 155 8.310 -7.397 1.295 1.00 0.00 H new ATOM 0 HE2 TYR A 155 11.852 -8.742 3.321 1.00 0.00 H new ATOM 0 HH TYR A 155 10.590 -9.985 1.668 1.00 0.00 H new ATOM 2431 N GLU A 156 11.757 -1.116 1.655 1.00 0.00 N ATOM 2432 CA GLU A 156 11.954 0.338 1.926 1.00 0.00 C ATOM 2433 C GLU A 156 10.654 0.936 2.467 1.00 0.00 C ATOM 2434 O GLU A 156 9.596 0.768 1.889 1.00 0.00 O ATOM 2435 CB GLU A 156 12.342 1.050 0.629 1.00 0.00 C ATOM 2436 CG GLU A 156 13.754 0.626 0.216 1.00 0.00 C ATOM 2437 CD GLU A 156 14.256 1.542 -0.902 1.00 0.00 C ATOM 2438 OE1 GLU A 156 14.482 2.708 -0.628 1.00 0.00 O ATOM 2439 OE2 GLU A 156 14.407 1.059 -2.012 1.00 0.00 O ATOM 0 H GLU A 156 11.495 -1.344 0.696 1.00 0.00 H new ATOM 0 HA GLU A 156 12.747 0.467 2.662 1.00 0.00 H new ATOM 0 HB2 GLU A 156 11.632 0.804 -0.160 1.00 0.00 H new ATOM 0 HB3 GLU A 156 12.301 2.130 0.769 1.00 0.00 H new ATOM 0 HG2 GLU A 156 14.426 0.678 1.073 1.00 0.00 H new ATOM 0 HG3 GLU A 156 13.750 -0.410 -0.123 1.00 0.00 H new ATOM 2446 N VAL A 157 10.727 1.633 3.572 1.00 0.00 N ATOM 2447 CA VAL A 157 9.500 2.247 4.160 1.00 0.00 C ATOM 2448 C VAL A 157 9.621 3.770 4.118 1.00 0.00 C ATOM 2449 O VAL A 157 10.444 4.355 4.797 1.00 0.00 O ATOM 2450 CB VAL A 157 9.344 1.787 5.612 1.00 0.00 C ATOM 2451 CG1 VAL A 157 8.009 2.287 6.166 1.00 0.00 C ATOM 2452 CG2 VAL A 157 9.377 0.257 5.668 1.00 0.00 C ATOM 0 H VAL A 157 11.587 1.803 4.094 1.00 0.00 H new ATOM 0 HA VAL A 157 8.628 1.936 3.585 1.00 0.00 H new ATOM 0 HB VAL A 157 10.160 2.192 6.210 1.00 0.00 H new ATOM 0 HG11 VAL A 157 7.898 1.959 7.200 1.00 0.00 H new ATOM 0 HG12 VAL A 157 7.983 3.376 6.126 1.00 0.00 H new ATOM 0 HG13 VAL A 157 7.192 1.883 5.568 1.00 0.00 H new ATOM 0 HG21 VAL A 157 9.266 -0.072 6.701 1.00 0.00 H new ATOM 0 HG22 VAL A 157 8.561 -0.147 5.069 1.00 0.00 H new ATOM 0 HG23 VAL A 157 10.328 -0.101 5.273 1.00 0.00 H new ATOM 2462 N TRP A 158 8.805 4.416 3.324 1.00 0.00 N ATOM 2463 CA TRP A 158 8.863 5.904 3.230 1.00 0.00 C ATOM 2464 C TRP A 158 7.622 6.507 3.891 1.00 0.00 C ATOM 2465 O TRP A 158 6.645 5.823 4.132 1.00 0.00 O ATOM 2466 CB TRP A 158 8.909 6.321 1.758 1.00 0.00 C ATOM 2467 CG TRP A 158 10.197 5.865 1.151 1.00 0.00 C ATOM 2468 CD1 TRP A 158 10.580 4.574 1.019 1.00 0.00 C ATOM 2469 CD2 TRP A 158 11.276 6.672 0.595 1.00 0.00 C ATOM 2470 NE1 TRP A 158 11.824 4.536 0.415 1.00 0.00 N ATOM 2471 CE2 TRP A 158 12.295 5.804 0.135 1.00 0.00 C ATOM 2472 CE3 TRP A 158 11.467 8.057 0.445 1.00 0.00 C ATOM 2473 CZ2 TRP A 158 13.462 6.294 -0.453 1.00 0.00 C ATOM 2474 CZ3 TRP A 158 12.640 8.553 -0.145 1.00 0.00 C ATOM 2475 CH2 TRP A 158 13.636 7.673 -0.593 1.00 0.00 C ATOM 0 H TRP A 158 8.099 3.974 2.735 1.00 0.00 H new ATOM 0 HA TRP A 158 9.757 6.265 3.739 1.00 0.00 H new ATOM 0 HB2 TRP A 158 8.067 5.887 1.219 1.00 0.00 H new ATOM 0 HB3 TRP A 158 8.818 7.404 1.673 1.00 0.00 H new ATOM 0 HD1 TRP A 158 10.008 3.714 1.334 1.00 0.00 H new ATOM 0 HE1 TRP A 158 12.331 3.677 0.202 1.00 0.00 H new ATOM 0 HE3 TRP A 158 10.706 8.744 0.786 1.00 0.00 H new ATOM 0 HZ2 TRP A 158 14.225 5.612 -0.797 1.00 0.00 H new ATOM 0 HZ3 TRP A 158 12.776 9.619 -0.255 1.00 0.00 H new ATOM 0 HH2 TRP A 158 14.536 8.061 -1.046 1.00 0.00 H new ATOM 2486 N GLN A 159 7.656 7.782 4.184 1.00 0.00 N ATOM 2487 CA GLN A 159 6.481 8.439 4.831 1.00 0.00 C ATOM 2488 C GLN A 159 6.274 9.826 4.221 1.00 0.00 C ATOM 2489 O GLN A 159 7.215 10.571 4.018 1.00 0.00 O ATOM 2490 CB GLN A 159 6.736 8.573 6.333 1.00 0.00 C ATOM 2491 CG GLN A 159 6.522 7.218 7.011 1.00 0.00 C ATOM 2492 CD GLN A 159 5.025 6.977 7.209 1.00 0.00 C ATOM 2493 OE1 GLN A 159 4.294 7.879 7.566 1.00 0.00 O ATOM 2494 NE2 GLN A 159 4.534 5.788 6.991 1.00 0.00 N ATOM 0 H GLN A 159 8.449 8.397 4.002 1.00 0.00 H new ATOM 0 HA GLN A 159 5.589 7.834 4.667 1.00 0.00 H new ATOM 0 HB2 GLN A 159 7.753 8.923 6.510 1.00 0.00 H new ATOM 0 HB3 GLN A 159 6.064 9.316 6.762 1.00 0.00 H new ATOM 0 HG2 GLN A 159 6.952 6.423 6.402 1.00 0.00 H new ATOM 0 HG3 GLN A 159 7.035 7.196 7.972 1.00 0.00 H new ATOM 0 HE21 GLN A 159 5.147 5.030 6.691 1.00 0.00 H new ATOM 0 HE22 GLN A 159 3.537 5.616 7.120 1.00 0.00 H new ATOM 2503 N LYS A 160 5.047 10.179 3.930 1.00 0.00 N ATOM 2504 CA LYS A 160 4.768 11.517 3.334 1.00 0.00 C ATOM 2505 C LYS A 160 4.943 12.599 4.402 1.00 0.00 C ATOM 2506 O LYS A 160 4.566 12.419 5.545 1.00 0.00 O ATOM 2507 CB LYS A 160 3.332 11.550 2.805 1.00 0.00 C ATOM 2508 CG LYS A 160 3.171 12.722 1.836 1.00 0.00 C ATOM 2509 CD LYS A 160 1.816 12.620 1.132 1.00 0.00 C ATOM 2510 CE LYS A 160 1.520 13.931 0.401 1.00 0.00 C ATOM 2511 NZ LYS A 160 0.255 13.792 -0.376 1.00 0.00 N ATOM 0 H LYS A 160 4.225 9.594 4.081 1.00 0.00 H new ATOM 0 HA LYS A 160 5.462 11.701 2.514 1.00 0.00 H new ATOM 0 HB2 LYS A 160 3.098 10.613 2.300 1.00 0.00 H new ATOM 0 HB3 LYS A 160 2.630 11.650 3.633 1.00 0.00 H new ATOM 0 HG2 LYS A 160 3.242 13.666 2.376 1.00 0.00 H new ATOM 0 HG3 LYS A 160 3.976 12.713 1.101 1.00 0.00 H new ATOM 0 HD2 LYS A 160 1.823 11.791 0.425 1.00 0.00 H new ATOM 0 HD3 LYS A 160 1.031 12.412 1.859 1.00 0.00 H new ATOM 0 HE2 LYS A 160 1.431 14.747 1.118 1.00 0.00 H new ATOM 0 HE3 LYS A 160 2.344 14.181 -0.267 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 0.053 14.683 -0.873 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 0.356 13.024 -1.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 -0.528 13.572 0.272 1.00 0.00 H new ATOM 2525 N LYS A 161 5.513 13.719 4.036 1.00 0.00 N ATOM 2526 CA LYS A 161 5.718 14.819 5.023 1.00 0.00 C ATOM 2527 C LYS A 161 5.467 16.168 4.345 1.00 0.00 C ATOM 2528 O LYS A 161 6.032 16.465 3.309 1.00 0.00 O ATOM 2529 CB LYS A 161 7.155 14.772 5.548 1.00 0.00 C ATOM 2530 CG LYS A 161 7.293 13.632 6.558 1.00 0.00 C ATOM 2531 CD LYS A 161 8.689 13.670 7.183 1.00 0.00 C ATOM 2532 CE LYS A 161 8.761 12.663 8.332 1.00 0.00 C ATOM 2533 NZ LYS A 161 9.990 12.917 9.137 1.00 0.00 N ATOM 0 H LYS A 161 5.846 13.918 3.093 1.00 0.00 H new ATOM 0 HA LYS A 161 5.023 14.695 5.853 1.00 0.00 H new ATOM 0 HB2 LYS A 161 7.851 14.626 4.722 1.00 0.00 H new ATOM 0 HB3 LYS A 161 7.413 15.721 6.018 1.00 0.00 H new ATOM 0 HG2 LYS A 161 6.533 13.725 7.334 1.00 0.00 H new ATOM 0 HG3 LYS A 161 7.130 12.674 6.065 1.00 0.00 H new ATOM 0 HD2 LYS A 161 9.442 13.434 6.431 1.00 0.00 H new ATOM 0 HD3 LYS A 161 8.908 14.673 7.550 1.00 0.00 H new ATOM 0 HE2 LYS A 161 7.876 12.750 8.962 1.00 0.00 H new ATOM 0 HE3 LYS A 161 8.774 11.646 7.939 1.00 0.00 H new ATOM 0 HZ1 LYS A 161 10.040 12.233 9.919 1.00 0.00 H new ATOM 0 HZ2 LYS A 161 10.829 12.813 8.532 1.00 0.00 H new ATOM 0 HZ3 LYS A 161 9.959 13.882 9.523 1.00 0.00 H new ATOM 2547 N ALA A 162 4.622 16.983 4.923 1.00 0.00 N ATOM 2548 CA ALA A 162 4.326 18.316 4.319 1.00 0.00 C ATOM 2549 C ALA A 162 3.921 19.296 5.422 1.00 0.00 C ATOM 2550 O ALA A 162 2.921 19.044 6.074 1.00 0.00 O ATOM 2551 CB ALA A 162 3.182 18.179 3.314 1.00 0.00 C ATOM 2552 OXT ALA A 162 4.617 20.284 5.595 1.00 0.00 O ATOM 0 H ALA A 162 4.123 16.782 5.790 1.00 0.00 H new ATOM 0 HA ALA A 162 5.214 18.689 3.809 1.00 0.00 H new ATOM 0 HB1 ALA A 162 2.966 19.152 2.873 1.00 0.00 H new ATOM 0 HB2 ALA A 162 3.470 17.481 2.528 1.00 0.00 H new ATOM 0 HB3 ALA A 162 2.293 17.806 3.823 1.00 0.00 H new TER 2558 ALA A 162 HETATM 2559 N1 TMQ A 170 3.953 -8.555 -1.728 1.00 0.00 N HETATM 2560 C2 TMQ A 170 3.757 -7.429 -1.026 1.00 0.00 C HETATM 2561 N3 TMQ A 170 2.613 -6.709 -1.123 1.00 0.00 N HETATM 2562 C4 TMQ A 170 1.598 -7.109 -1.951 1.00 0.00 C HETATM 2563 C3A TMQ A 170 3.002 -9.048 -2.588 1.00 0.00 C HETATM 2564 C4A TMQ A 170 1.729 -8.327 -2.752 1.00 0.00 C HETATM 2565 C5 TMQ A 170 0.740 -8.896 -3.689 1.00 0.00 C HETATM 2566 C6 TMQ A 170 1.057 -10.119 -4.396 1.00 0.00 C HETATM 2567 C7 TMQ A 170 2.290 -10.763 -4.197 1.00 0.00 C HETATM 2568 C8 TMQ A 170 3.242 -10.247 -3.319 1.00 0.00 C HETATM 2569 C9 TMQ A 170 0.063 -10.734 -5.369 1.00 0.00 C HETATM 2570 N10 TMQ A 170 0.405 -12.103 -5.771 1.00 0.00 N HETATM 2571 C11 TMQ A 170 0.330 -13.151 -4.881 1.00 0.00 C HETATM 2572 C12 TMQ A 170 -0.464 -13.059 -3.703 1.00 0.00 C HETATM 2573 C13 TMQ A 170 -0.533 -14.169 -2.784 1.00 0.00 C HETATM 2574 C14 TMQ A 170 0.194 -15.352 -3.069 1.00 0.00 C HETATM 2575 C15 TMQ A 170 0.988 -15.455 -4.240 1.00 0.00 C HETATM 2576 C16 TMQ A 170 1.052 -14.337 -5.151 1.00 0.00 C HETATM 2577 C17 TMQ A 170 -0.609 -8.250 -3.948 1.00 0.00 C HETATM 2578 O18 TMQ A 170 -1.314 -14.126 -1.589 1.00 0.00 O HETATM 2579 O19 TMQ A 170 0.128 -16.419 -2.196 1.00 0.00 O HETATM 2580 O20 TMQ A 170 1.698 -16.671 -4.472 1.00 0.00 O HETATM 2581 C21 TMQ A 170 -2.351 -13.146 -1.653 1.00 0.00 C HETATM 2582 C22 TMQ A 170 1.297 -16.417 -1.415 1.00 0.00 C HETATM 2583 C23 TMQ A 170 2.031 -16.850 -5.849 1.00 0.00 C HETATM 2584 N24 TMQ A 170 4.736 -6.997 -0.195 1.00 0.00 N HETATM 2585 N25 TMQ A 170 0.503 -6.293 -1.951 1.00 0.00 N HETATM 0 HN52 TMQ A 170 -0.300 -6.517 -2.539 1.00 0.00 H new HETATM 0 HN51 TMQ A 170 0.488 -5.460 -1.363 1.00 0.00 H new HETATM 0 HN22 TMQ A 170 4.605 -6.143 0.347 1.00 0.00 H new HETATM 0 HN21 TMQ A 170 5.604 -7.526 -0.111 1.00 0.00 H new HETATM 0 H233 TMQ A 170 1.118 -16.874 -6.444 1.00 0.00 H new HETATM 0 H232 TMQ A 170 2.659 -16.024 -6.182 1.00 0.00 H new HETATM 0 H231 TMQ A 170 2.570 -17.789 -5.974 1.00 0.00 H new HETATM 0 H223 TMQ A 170 2.168 -16.516 -2.063 1.00 0.00 H new HETATM 0 H222 TMQ A 170 1.362 -15.481 -0.860 1.00 0.00 H new HETATM 0 H221 TMQ A 170 1.269 -17.253 -0.716 1.00 0.00 H new HETATM 0 H213 TMQ A 170 -1.911 -12.160 -1.804 1.00 0.00 H new HETATM 0 H212 TMQ A 170 -3.018 -13.376 -2.483 1.00 0.00 H new HETATM 0 H211 TMQ A 170 -2.916 -13.153 -0.721 1.00 0.00 H new HETATM 0 H173 TMQ A 170 -1.171 -8.195 -3.016 1.00 0.00 H new HETATM 0 H172 TMQ A 170 -0.461 -7.245 -4.342 1.00 0.00 H new HETATM 0 H171 TMQ A 170 -1.165 -8.846 -4.672 1.00 0.00 H new HETATM 0 HN1 TMQ A 170 0.704 -12.282 -6.729 1.00 0.00 H new HETATM 0 HN TMQ A 170 4.833 -9.059 -1.620 1.00 0.00 H new HETATM 0 H92 TMQ A 170 -0.927 -10.735 -4.912 1.00 0.00 H new HETATM 0 H91 TMQ A 170 0.003 -10.107 -6.259 1.00 0.00 H new HETATM 0 H8 TMQ A 170 4.189 -10.771 -3.189 1.00 0.00 H new HETATM 0 H7 TMQ A 170 2.506 -11.683 -4.739 1.00 0.00 H new HETATM 0 H16 TMQ A 170 1.661 -14.407 -6.053 1.00 0.00 H new HETATM 0 H12 TMQ A 170 -1.022 -12.146 -3.495 1.00 0.00 H new